data_2mhs_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 2mhs _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 120.589 0.233 . . . . 71.14 110.394 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -57.28 -45.83 83.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.3 0.571 . . . . 63.42 110.843 175.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 69.5 tp -59.84 -38.88 83.32 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.716 -0.675 . . . . 71.42 111.089 175.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.25 -44.55 91.46 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.112 -0.494 . . . . 63.12 110.941 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mmm180 -63.49 -43.62 96.73 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.004 0.372 . . . . 74.33 112.004 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.43 ' O ' HG13 ' A' ' 12' ' ' ILE . 50.5 tt0 -60.62 -52.36 65.48 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.906 0.384 . . . . 75.32 111.35 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 p -61.6 -44.3 97.26 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.316 -0.402 . . . . 72.41 111.2 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.0 tp -54.83 -44.89 74.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.082 -0.508 . . . . 73.44 111.62 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 9.9 tp10 -61.95 -49.85 74.48 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.797 0.332 . . . . 74.5 111.166 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 8' ' ' GLN . 66.6 mt -54.84 -52.68 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.228 0.537 . . . . 74.43 111.106 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 99' ' ' ILE . 81.5 mt -64.78 -41.42 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.723 -0.671 . . . . 74.41 111.392 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -56.49 -46.29 80.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.339 -0.391 . . . . 63.42 111.418 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.477 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 62.5 mtp180 -61.89 -53.89 49.52 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.455 -0.339 . . . . 75.12 111.159 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.65 -42.02 67.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.821 0.343 . . . . 75.44 111.859 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.47 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.5 mp -65.69 -42.53 91.13 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.973 0.36 . . . . 71.12 111.973 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -66.84 -40.16 87.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 122.2 -0.312 . . . . 71.31 111.594 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 45.6 mt-10 -61.73 -50.61 71.71 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.108 0.48 . . . . 51.34 111.026 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.417 ' HG3' ' HB2' ' A' ' 103' ' ' ALA . 27.3 mm-40 -59.66 -40.01 86.33 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.206 -0.452 . . . . 64.12 111.714 176.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -64.62 -42.55 95.43 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.035 0.445 . . . . 74.02 111.847 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.458 HG21 ' HE2' ' A' ' 110' ' ' LYS . 69.4 p -87.49 -7.25 57.84 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.253 -0.43 . . . . 71.14 112.039 -176.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 C-N-CA 121.193 -0.527 . . . . 72.43 113.379 178.534 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.919 0 N-CA-C 114.28 0.472 . . . . 71.22 114.28 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.04 -49.95 14.19 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 122.615 -0.344 . . . . 72.21 111.855 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.8 m -55.15 -48.27 73.95 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.152 0.427 . . . . 65.32 112.152 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 m -68.01 -34.67 76.95 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.701 0.286 . . . . 73.2 111.503 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.454 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -63.58 -54.92 28.45 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.733 0.301 . . . . 61.34 111.449 176.314 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HG3' HG22 ' A' ' 147' ' ' VAL . 18.5 ptmt -63.39 -36.85 85.1 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.844 0.355 . . . . 72.33 111.144 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -62.99 -46.79 86.04 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.656 0.265 . . . . 63.23 111.424 176.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.3 tp -61.06 -50.65 72.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.255 0.465 . . . . 74.52 112.255 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.8 pt-20 -64.8 -35.89 82.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 122.136 -0.353 . . . . 65.25 111.675 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 47' ' ' VAL . 53.6 m -65.96 -47.32 75.02 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.713 0.292 . . . . 72.14 110.695 174.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.3 mt -53.95 -49.43 68.73 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.229 0.455 . . . . 72.42 112.229 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.448 HH11 ' HD2' ' A' ' 45' ' ' ARG . 10.7 ptm180 -66.43 -41.62 88.92 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.116 0.413 . . . . 65.01 112.116 -176.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -70.32 -42.99 71.23 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.152 0.427 . . . . 73.23 112.152 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 43' ' ' THR . 25.4 m -82.78 -33.48 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 122.035 -0.416 . . . . 74.33 111.427 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -62.11 -40.8 99.42 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.453 -0.403 . . . . 63.31 112.675 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 17.4 t70 -55.82 -47.69 76.75 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.971 0.415 . . . . 70.43 110.921 174.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.05 -44.21 96.44 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.972 -0.632 . . . . 75.21 112.63 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.5 t -57.89 -44.36 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-O 120.742 0.306 . . . . 74.31 111.063 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.45 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 76.8 mt-30 -60.33 -42.65 96.09 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.598 -0.273 . . . . 65.51 111.373 176.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.1 mmm180 -55.2 -52.66 62.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 111.975 0.361 . . . . 74.42 111.975 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -75.33 -33.21 61.11 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.16 0.43 . . . . 71.22 112.16 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -90.91 -17.62 26.13 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.765 1.024 . . . . 74.13 113.765 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -48.72 -50.25 34.39 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 118.163 0.438 . . . . 74.34 112.163 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.2 t -55.92 -31.09 62.59 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.046 0.388 . . . . 71.32 112.046 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.63 -48.61 11.52 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.38 -0.373 . . . . 52.25 111.692 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -58.55 -47.12 85.3 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.487 -0.324 . . . . 72.44 111.703 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -52.38 -30.4 28.81 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.877 0.37 . . . . 75.34 111.758 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.16 -39.99 95.16 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.285 -0.483 . . . . 51.22 113.017 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.0 mtm -90.6 -34.71 15.37 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.269 0.557 . . . . 71.42 110.575 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -58.56 -36.87 74.6 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.955 -0.566 . . . . 71.12 111.596 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -60.11 -39.43 86.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.222 -0.445 . . . . 71.43 111.849 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 -9.78 43.03 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 111.814 0.301 . . . . 75.43 111.814 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.1 mt -82.2 -76.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.656 0.265 . . . . 75.35 110.61 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 47.21 91.89 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.527 0.731 . . . . 74.51 112.321 -178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.513 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -76.68 110.12 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.243 0.545 . . . . 71.11 112.019 -175.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HD2' ' ND2' ' A' ' 70' ' ' ASN . 0.6 OUTLIER -102.16 -6.92 22.68 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.037 -0.528 . . . . 75.14 112.094 178.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.401 ' ND2' ' HD2' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.12 169.73 15.82 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.748 0.309 . . . . 73.04 111.521 173.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -54.31 -32.09 55.65 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.546 0.573 . . . . 63.22 112.546 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.35 -35.14 67.3 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.869 0.366 . . . . 73.04 111.729 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.513 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.3 m-20 -68.92 -35.52 76.92 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.02 0.438 . . . . 70.02 110.454 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.84 -41.1 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.218 0.532 . . . . 54.2 110.519 175.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -59.07 -32.16 69.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.034 -0.53 . . . . 64.11 110.856 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -72.13 -40.26 68.23 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.144 -0.48 . . . . 70.23 110.801 174.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.1 mt -56.49 -33.68 66.21 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.558 -0.292 . . . . 74.1 111.007 176.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 82' ' ' ILE . 28.8 t -51.75 -42.18 62.14 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.299 -0.41 . . . . 74.54 111.494 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.93 -43.04 99.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.896 0.379 . . . . 72.5 111.063 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.465 ' O ' HG21 ' A' ' 84' ' ' VAL . 79.8 t -63.52 -44.19 98.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 120.948 0.404 . . . . 65.25 110.745 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -55.73 -39.23 70.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.975 -0.557 . . . . 75.22 111.625 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 78' ' ' SER . 76.5 mt -62.11 -44.36 98.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-O 121.175 0.512 . . . . 71.15 111.165 175.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -65.0 -27.9 69.14 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.395 -0.366 . . . . 73.31 111.955 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.465 HG21 ' O ' ' A' ' 80' ' ' VAL . 66.8 t -58.66 -20.99 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.807 0.337 . . . . 61.12 111.672 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.49 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 37.7 m-85 . . . . . 0 N--CA 1.472 0.635 0 N-CA-C 112.352 0.501 . . . . 74.03 112.352 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.458 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.8 m95 . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 120.837 0.351 . . . . 74.54 111.234 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.03 -28.5 61.11 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 121.244 -0.503 . . . . 72.02 112.893 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -70.17 -34.53 73.1 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.547 -0.384 . . . . 72.32 111.173 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.458 HG13 ' HE3' ' A' ' 92' ' ' TRP . 29.0 mm -58.13 -45.98 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.601 0.715 . . . . 74.55 109.437 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.76 -44.72 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 115.248 -0.887 . . . . 74.52 111.085 174.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.5 m -61.43 -35.71 78.32 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.292 -0.413 . . . . 62.33 111.344 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.49 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 22.8 tp -62.77 -55.31 27.68 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.34 0.59 . . . . 72.14 110.952 176.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 13' ' ' ILE . 56.3 mt -67.11 -35.24 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.862 -0.608 . . . . 44.21 111.377 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.0 t -65.52 -47.08 77.17 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.004 -0.544 . . . . 65.23 111.19 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.439 ' O ' HG21 ' A' ' 105' ' ' VAL . 22.3 t80 -62.99 -39.82 95.92 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.748 0.308 . . . . 74.2 110.593 176.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.7 -46.13 89.73 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.856 -0.688 . . . . 65.42 112.274 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.47 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.878 0.37 . . . . 74.31 111.547 176.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.13 -39.34 94.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.978 0.418 . . . . 75.44 111.017 178.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.439 HG21 ' O ' ' A' ' 101' ' ' PHE . 40.6 t -75.09 -38.97 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 120.941 0.4 . . . . 72.33 110.64 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.76 82.87 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.42 0.526 . . . . 75.11 112.42 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.568 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 18.3 ptpt -62.46 -34.89 77.71 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.76 0.314 . . . . 63.4 111.006 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.417 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -65.72 -37.69 87.11 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.853 0.358 . . . . 71.04 110.505 173.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.509 HD21 ' HB ' ' A' ' 68' ' ' ILE . 87.6 mt -61.78 -50.28 72.97 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.367 -0.379 . . . . 75.23 111.609 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 66.4 tttp -63.02 -35.64 80.91 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.994 -0.441 . . . . 74.22 110.79 177.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 85.0 m -56.19 -41.67 75.91 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.928 0.394 . . . . 74.5 110.846 175.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.5 pt -97.97 20.4 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 112.08 0.4 . . . . 74.33 112.08 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 71.78 3.45 4.67 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.561 0.948 . . . . 72.52 113.561 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -84.82 45.55 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.601 0.593 . . . . 61.24 112.601 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.58 -34.25 76.6 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.117 0.414 . . . . 74.22 112.117 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.4 m -58.88 -26.52 64.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.821 0.343 . . . . 73.23 111.49 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -77.83 -27.52 49.96 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.551 -0.295 . . . . 72.4 111.714 178.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.7 mt -57.68 -46.27 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.622 0.601 . . . . 63.54 112.622 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.84 -52.05 44.11 Favored Pre-proline 0 CA--C 1.55 0.943 0 N-CA-C 112.577 0.584 . . . . 74.2 112.577 -174.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.15 -27.45 84.91 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.802 1.668 . . . . 74.43 112.134 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -64.71 -48.0 76.26 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.711 -0.477 . . . . 72.22 109.711 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.431 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -56.04 -39.97 72.8 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.001 0.429 . . . . 72.32 111.031 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.09 -36.89 85.51 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.214 -0.448 . . . . 73.11 111.061 174.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -64.42 -43.18 95.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 120.79 0.329 . . . . 74.34 111.209 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.3 mm -56.52 -52.92 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.27 0.557 . . . . 71.3 110.57 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 m -64.54 -35.17 80.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.76 -0.654 . . . . 72.24 111.39 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.33 -52.74 63.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.37 -0.377 . . . . 74.2 111.197 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' HG21 ' A' ' 132' ' ' THR . 66.5 t -64.27 -42.04 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 121.027 0.441 . . . . 62.12 110.791 177.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.542 ' HG ' HD13 ' A' ' 137' ' ' LEU . 43.1 tp -54.27 -52.87 60.03 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.866 -0.607 . . . . 74.34 111.257 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.574 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 85.0 t -74.85 -23.85 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 115.958 -0.564 . . . . 74.54 111.85 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -70.17 -46.79 63.91 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.092 0.404 . . . . 73.53 112.092 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.539 HG23 ' HG2' ' A' ' 133' ' ' LYS . 8.0 t -108.26 -34.99 6.66 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.373 0.879 . . . . 75.3 113.373 -176.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.539 ' HG2' HG23 ' A' ' 132' ' ' THR . 75.5 mmtt -99.39 18.66 17.18 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.938 -0.477 . . . . 75.21 112.017 -177.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.574 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 9.0 tpt180 -46.32 -61.71 1.67 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.101 0.56 . . . . 45.15 112.481 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -62.48 -41.41 98.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.927 -0.578 . . . . 73.14 111.985 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -59.55 -38.31 80.74 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.797 0.332 . . . . 65.2 111.509 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.542 HD13 ' HG ' ' A' ' 129' ' ' LEU . 61.7 mt -56.62 -51.15 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.395 -0.366 . . . . 73.33 111.919 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.7 p -78.16 -43.6 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 63.41 112.383 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -61.13 -50.5 72.97 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.216 0.451 . . . . 70.1 112.216 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -94.08 9.84 36.09 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.014 0.435 . . . . 74.04 111.057 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 143' ' ' TRP . 48.0 mtm180 58.89 25.58 13.84 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.74 -0.664 . . . . 75.11 111.745 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 24.53 -79.78 0.0 OUTLIER Glycine 0 N--CA 1.471 1.013 0 N-CA-C 115.562 0.985 . . . . 61.24 115.562 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.428 ' N ' ' O ' ' A' ' 141' ' ' ARG . 31.4 m95 -70.83 -46.08 63.38 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.805 0.336 . . . . 74.23 111.678 -176.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.78 -40.49 95.37 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.2 0.524 . . . . 74.23 110.218 175.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.99 -31.17 67.06 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.847 -0.615 . . . . 62.42 112.705 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -63.54 -46.37 86.31 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.108 0.563 . . . . 73.13 111.613 178.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.574 HG13 ' HB ' ' A' ' 152' ' ' VAL . 96.7 t -67.44 -36.26 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 112.33 0.493 . . . . 53.34 112.33 -178.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.01 -38.04 64.21 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 122.204 -0.31 . . . . 71.34 111.157 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.96 -48.14 83.2 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.824 0.345 . . . . 73.42 111.453 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -82.5 -1.59 50.9 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.058 0.392 . . . . 72.5 112.058 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.2 t60 56.65 72.48 0.5 Allowed 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.47 0.545 . . . . 73.51 112.47 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.574 ' HB ' HG13 ' A' ' 147' ' ' VAL . 97.6 t . . . . . 0 N--CA 1.471 0.587 0 O-C-N 122.256 -0.278 . . . . 71.34 110.866 174.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 m-20 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 120.897 0.38 . . . . 73.42 111.597 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.21 -30.82 71.75 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.495 0.664 . . . . 63.53 109.262 171.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.0 tp -55.37 -43.82 75.48 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.454 -0.794 . . . . 73.11 110.669 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.437 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 58.8 t80 -60.54 -47.51 85.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.541 -0.754 . . . . 74.12 111.314 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -71.36 -31.34 67.22 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.077 0.399 . . . . 72.53 112.077 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.442 ' O ' HG13 ' A' ' 12' ' ' ILE . 41.0 tt0 -65.61 -53.34 43.03 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.169 0.509 . . . . 64.34 110.58 175.207 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 p -61.08 -42.47 98.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.808 -0.633 . . . . 62.21 110.961 178.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 tp -55.33 -47.69 75.29 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.022 -0.536 . . . . 74.33 112.047 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.94 -41.46 91.29 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.798 0.332 . . . . 74.43 111.082 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 8' ' ' GLN . 81.6 mt -59.04 -54.14 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.108 0.48 . . . . 74.25 111.074 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.427 ' O ' HD11 ' A' ' 17' ' ' LEU . 80.8 mt -61.76 -44.95 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.02 -0.537 . . . . 74.24 111.235 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.3 t -54.83 -46.6 74.63 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.772 0.32 . . . . 73.41 111.365 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.543 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 9.9 mtp180 -57.96 -58.02 10.26 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.698 0.285 . . . . 64.01 110.963 175.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.409 ' HH ' ' HA3' ' A' ' 48' ' ' GLY . 59.2 t80 -53.68 -44.72 69.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.029 -0.532 . . . . 75.52 111.991 -174.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.0 mp -59.95 -45.98 90.91 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.539 -0.3 . . . . 74.51 111.556 177.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.435 ' HG3' HH11 ' A' ' 18' ' ' ARG . 39.5 mmm-85 -65.91 -43.88 86.87 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.777 0.323 . . . . 74.4 111.399 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 42.1 mt-10 -63.26 -41.95 99.09 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.892 0.377 . . . . 44.15 111.489 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -71.43 -40.62 70.29 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.8 0.333 . . . . 73.23 111.735 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.92 97.6 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.963 0.411 . . . . 74.11 111.723 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.9 p -89.04 -16.16 32.31 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.259 0.466 . . . . 52.3 112.259 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.9 0 C-N-CA 120.957 -0.639 . . . . 72.51 112.465 -176.444 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.861 0 N-CA-C 114.286 0.475 . . . . 65.22 114.286 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.58 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -60.43 -50.83 72.03 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.063 0.394 . . . . 55.11 112.063 -176.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.3 m -58.82 -38.82 79.51 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.98 0.419 . . . . 74.31 111.477 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.8 p -73.24 -39.07 65.76 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.535 -0.302 . . . . 53.32 111.505 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -59.54 -54.58 44.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.808 0.337 . . . . 74.52 111.265 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.58 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 22.5 mtpp -55.33 -41.59 72.65 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.055 -0.521 . . . . 64.3 110.894 -177.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.23 82.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.237 -0.438 . . . . 45.2 111.465 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.04 -53.12 60.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.126 0.417 . . . . 73.02 112.126 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -66.51 -21.37 66.17 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.173 -0.33 . . . . 72.22 111.829 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' HG21 ' A' ' 47' ' ' VAL . 97.4 m -77.5 -42.31 36.14 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.807 0.337 . . . . 71.55 110.265 170.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.25 -40.79 71.35 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.375 -0.375 . . . . 72.52 111.72 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.405 ' HA ' ' HE1' ' A' ' 16' ' ' TYR . 5.7 ptm180 -72.65 -37.63 67.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.055 -0.403 . . . . 64.21 111.231 178.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -66.91 -44.89 79.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.993 0.425 . . . . 63.23 111.68 -178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 51' ' ' VAL . 18.7 m -90.94 -33.65 5.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 120.891 0.377 . . . . 75.21 111.533 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.466 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.25 -47.16 83.23 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 116.076 -0.511 . . . . 71.41 113.902 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.558 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 13.7 t70 -51.71 -53.31 40.67 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 117.472 0.636 . . . . 62.1 110.621 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.88 -46.48 90.49 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.994 -0.548 . . . . 64.41 113.112 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.0 t -57.62 -42.21 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 O-C-N 122.786 -0.244 . . . . 71.35 111.033 177.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.556 ' HG2' ' HG ' ' A' ' 100' ' ' SER . 77.3 mt-30 -59.32 -53.39 58.78 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.586 -0.279 . . . . 74.04 110.982 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 9.0 mmm180 -58.33 -41.24 84.16 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.738 0.304 . . . . 73.1 111.756 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -71.42 -46.05 61.12 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.289 0.566 . . . . 72.13 111.685 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -80.16 -17.53 52.19 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.858 -0.61 . . . . 74.51 112.479 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 38.0 tt0 -48.18 -54.82 12.1 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.863 0.69 . . . . 73.44 112.863 -172.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.97 -31.55 67.0 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.902 0.382 . . . . 74.43 111.843 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.7 -36.24 60.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.842 0.353 . . . . 75.05 111.542 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -76.06 -31.76 58.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.947 0.351 . . . . 72.23 111.947 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -48.35 -39.58 22.56 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.855 0.36 . . . . 70.31 111.776 178.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.46 -37.95 61.61 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 116.052 -0.522 . . . . 74.55 113.761 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.466 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 56.9 mtm -90.45 -38.96 12.92 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.119 -0.636 . . . . 64.13 110.506 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.55 HD23 ' CE2' ' A' ' 104' ' ' PHE . 13.5 tp -54.49 -43.85 72.13 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.871 -0.604 . . . . 72.02 111.868 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -57.22 -30.18 64.37 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.811 0.671 . . . . 63.23 112.811 -177.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 62' ' ' MET . 19.0 pttp -101.26 4.82 42.12 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.866 0.365 . . . . 50.04 111.854 -177.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.4 mt -99.94 -69.57 0.76 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.704 0.288 . . . . 75.51 110.868 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 71.7 -48.63 0.68 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.479 0.918 . . . . 72.52 113.479 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.419 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.6 mp 62.97 98.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.571 0.7 . . . . 74.25 111.476 -174.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -102.15 -9.56 20.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.863 -179.332 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.434 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -163.12 177.55 9.01 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.459 0.541 . . . . 70.1 112.459 175.374 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.58 -41.85 54.93 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.847 0.684 . . . . 74.44 112.847 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.78 -39.38 68.33 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.659 0.266 . . . . 63.11 111.309 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.92 -41.93 95.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.197 0.523 . . . . 74.14 110.836 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.8 t -57.59 -48.06 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.26 0.552 . . . . 61.44 110.939 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.7 -26.24 65.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.311 -0.404 . . . . 74.15 111.321 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.0 t -65.73 -39.34 91.04 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.064 0.459 . . . . 52.21 110.682 172.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' A' ' 81' ' ' MET . 92.0 mt -59.14 -35.44 73.49 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.266 -0.425 . . . . 75.35 111.075 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.2 t -52.58 -40.43 62.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.916 0.388 . . . . 71.45 111.383 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -53.55 -35.97 61.33 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.287 -0.415 . . . . 72.12 111.46 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 58.2 t -82.72 -39.13 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.015 0.436 . . . . 75.12 111.183 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.4 mmt -54.37 -37.49 65.04 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.114 0.483 . . . . 71.41 111.366 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 78' ' ' SER . 74.7 mt -59.28 -40.03 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 116.22 -0.445 . . . . 44.45 111.518 175.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -66.62 -32.02 73.08 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 120.767 0.318 . . . . 74.34 111.474 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.3 t -57.39 -29.42 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-O 120.991 0.424 . . . . 74.24 111.542 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.45 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 25.2 m-85 . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.727 0.639 . . . . 72.45 112.727 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 92.4 m95 . . . . . 0 CA--C 1.538 0.497 0 CA-C-O 120.948 0.404 . . . . 74.11 111.411 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.86 -24.74 50.66 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.078 -0.582 . . . . 71.31 112.763 173.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -64.46 -39.08 93.13 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.641 -0.329 . . . . 74.23 110.767 174.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.9 mm -59.35 -48.68 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.336 0.589 . . . . 74.12 110.118 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.45 -46.88 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 115.541 -0.754 . . . . 63.12 110.988 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.5 m -59.26 -48.81 80.21 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.328 -0.396 . . . . 73.25 111.655 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.495 ' HG ' HG22 ' A' ' 125' ' ' ILE . 33.0 tp -56.59 -54.53 44.9 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.221 0.534 . . . . 71.12 111.485 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 53.5 mt -67.74 -32.99 59.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 116.018 -0.537 . . . . 73.22 111.148 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.556 ' HG ' ' HG2' ' A' ' 52' ' ' GLN . 30.2 t -60.48 -51.7 68.35 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.257 -0.429 . . . . 75.13 111.291 176.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.51 ' O ' HG21 ' A' ' 105' ' ' VAL . 28.4 t80 -64.42 -37.76 88.64 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.604 -0.271 . . . . 75.35 110.782 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -48.99 78.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.872 -0.68 . . . . 43.34 112.572 175.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.429 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.62 -35.99 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.109 0.481 . . . . 64.44 111.259 176.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.55 ' CE2' HD23 ' A' ' 63' ' ' LEU . 47.4 t80 -62.46 -44.2 96.98 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.045 -0.525 . . . . 65.21 111.115 178.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.51 HG21 ' O ' ' A' ' 101' ' ' PHE . 55.9 t -66.87 -37.53 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 120.824 0.345 . . . . 71.34 110.471 175.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.66 -38.54 72.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.237 -0.438 . . . . 61.34 111.655 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.6 -45.05 93.06 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.104 0.478 . . . . 74.04 110.734 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.447 ' O ' HG12 ' A' ' 112' ' ' ILE . 82.4 t60 -64.6 -39.95 94.63 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.212 -0.449 . . . . 71.03 110.704 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.23 -49.26 78.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.358 -0.383 . . . . 71.42 111.564 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -59.99 -44.13 94.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.095 0.474 . . . . 60.42 110.466 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.8 m -56.7 -45.09 82.04 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.113 -0.494 . . . . 75.34 111.706 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 108' ' ' HIS . 35.7 pt -87.15 12.66 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-O 120.92 0.391 . . . . 71.23 111.773 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 67.99 16.58 9.56 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.041 0.756 . . . . 61.3 113.041 174.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -92.74 38.86 1.03 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.83 0.348 . . . . 73.32 110.942 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.24 -32.95 67.08 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.083 0.401 . . . . 61.05 112.083 -176.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.5 p -56.26 -38.34 71.03 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.847 0.356 . . . . 74.55 111.704 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.5 m -61.96 -26.74 68.38 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.68 0.622 . . . . 75.43 112.68 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.8 mt -54.5 -45.36 70.57 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 112.874 0.694 . . . . 74.32 112.874 -176.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.32 -52.71 35.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 112.44 0.533 . . . . 73.44 112.44 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -26.11 81.66 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.75 1.633 . . . . 63.11 112.262 173.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.6 tt -66.16 -44.39 84.22 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.635 -0.505 . . . . 75.21 109.635 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.3 -37.67 75.54 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.219 -0.446 . . . . 70.45 110.896 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.05 -39.3 94.32 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.562 -0.29 . . . . 64.44 111.414 174.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.7 m -63.15 -45.71 90.63 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.016 0.436 . . . . 70.04 110.986 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.495 HG22 ' HG ' ' A' ' 98' ' ' LEU . 48.6 mm -56.58 -52.78 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.297 0.57 . . . . 65.33 110.794 175.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.6 m -65.91 -34.81 78.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.804 -0.635 . . . . 72.3 111.974 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 20.3 t70 -63.14 -50.27 71.08 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.458 -0.337 . . . . 71.52 110.53 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.419 HG22 ' HB2' ' A' ' 81' ' ' MET . 59.7 t -63.05 -39.82 86.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.053 0.454 . . . . 51.2 111.084 176.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.521 ' HG ' HD11 ' A' ' 137' ' ' LEU . 60.1 tp -53.28 -53.12 55.44 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.185 0.517 . . . . 72.03 111.338 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.491 ' HA ' ' HB3' ' A' ' 134' ' ' ARG . 42.0 t -73.6 -31.15 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 CA-C-N 116.038 -0.528 . . . . 43.34 111.756 177.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.7 tpt180 -52.54 -42.42 64.4 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.212 0.605 . . . . 61.41 112.389 -176.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.677 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.6 t -126.16 -21.67 4.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.723 1.009 . . . . 75.44 113.723 -175.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.677 ' HG2' HG23 ' A' ' 132' ' ' THR . 32.5 mmtp -122.67 13.27 10.01 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.293 0.849 . . . . 73.42 113.293 -173.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.625 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 0.2 OUTLIER -60.26 -40.46 90.43 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.537 0.684 . . . . 73.33 110.913 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' A' ' 134' ' ' ARG . 33.0 t70 -59.44 -50.63 73.2 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.146 -0.934 . . . . 53.44 110.803 177.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -59.05 -36.83 75.71 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.739 0.304 . . . . 71.22 111.549 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.521 HD11 ' HG ' ' A' ' 129' ' ' LEU . 88.1 mt -57.91 -49.33 77.1 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.436 -0.347 . . . . 74.22 111.791 176.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.8 p -77.6 -31.98 17.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 112.041 0.386 . . . . 55.1 112.041 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.4 mmtt -64.34 -58.58 6.09 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.08 0.466 . . . . 74.44 111.813 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -91.73 -1.32 57.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.089 0.403 . . . . 73.51 112.089 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 59.84 80.83 0.19 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.248 0.547 . . . . 65.43 110.242 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -55.31 -50.75 58.34 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.474 -0.784 . . . . 71.11 114.352 -171.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.414 ' O ' HG22 ' A' ' 147' ' ' VAL . 26.1 m95 -73.84 -36.27 64.89 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 117.014 0.407 . . . . 74.54 111.903 -175.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.22 -51.67 65.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.487 0.661 . . . . 61.43 110.741 174.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.07 -31.66 78.44 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.486 -0.779 . . . . 51.11 113.101 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.89 -45.21 82.71 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.118 0.485 . . . . 75.52 111.288 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 143' ' ' TRP . 48.2 t -65.61 -46.01 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.96 -0.564 . . . . 61.54 112.168 -178.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -27.73 61.24 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.101 0.408 . . . . 71.0 112.101 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -57.3 -49.1 77.19 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.215 0.531 . . . . 72.32 110.953 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -83.66 -0.3 50.09 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.263 -0.426 . . . . 73.2 111.472 173.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 19.3 t60 60.17 37.73 20.58 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.335 0.654 . . . . 73.15 112.055 175.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 120.873 0.368 . . . . 71.12 110.922 179.571 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.52 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 4.0 p30 . . . . . 0 CA--C 1.543 0.709 0 CA-C-O 120.745 0.307 . . . . 54.4 111.209 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.42 -46.08 91.28 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.385 0.513 . . . . 72.24 112.385 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.551 HD23 ' HG3' ' A' ' 134' ' ' ARG . 65.0 tp -61.28 -42.74 99.16 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.08 0.467 . . . . 73.45 110.628 -179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -56.42 -45.29 80.78 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.764 -0.653 . . . . 72.41 111.037 174.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.52 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 25.3 mmm180 -66.71 -48.47 69.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.127 0.417 . . . . 75.41 112.127 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.418 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.6 tt0 -62.1 -51.4 68.06 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.063 0.459 . . . . 73.34 110.964 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.2 p -57.13 -37.74 72.44 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.04 0.447 . . . . 75.33 110.627 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.522 HD13 ' HG2' ' A' ' 123' ' ' GLU . 44.1 tp -60.09 -46.04 90.93 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.919 -0.582 . . . . 72.35 111.993 178.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.9 pt-20 -67.09 -40.76 87.01 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 120.452 -0.499 . . . . 71.11 110.939 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.427 ' N ' ' HG3' ' A' ' 11' ' ' GLU . 66.3 mt -57.21 -53.6 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.158 0.504 . . . . 72.25 110.964 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.457 HG22 HG22 ' A' ' 99' ' ' ILE . 84.3 mt -66.91 -45.69 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 115.852 -0.613 . . . . 61.01 111.502 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 27.7 t -56.52 -53.94 51.66 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.406 -0.361 . . . . 71.44 111.416 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.631 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 40.3 mtt180 -55.95 -49.75 72.67 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.305 -0.257 . . . . 74.44 110.305 176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.469 ' CD2' HG23 ' A' ' 99' ' ' ILE . 62.7 t80 -52.54 -44.91 66.09 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.994 0.368 . . . . 71.51 111.994 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.8 mp -60.66 -40.83 93.51 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.371 -0.205 . . . . 74.44 111.21 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 14' ' ' SER . 31.3 mmm-85 -64.63 -42.41 95.51 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.952 0.406 . . . . 70.13 110.876 177.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 4.7 mm-40 -56.66 -49.94 73.55 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.594 0.712 . . . . 64.13 110.881 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -75.43 -30.8 60.15 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.702 -0.681 . . . . 73.12 112.463 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -38.14 73.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.021 0.439 . . . . 70.42 111.637 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.3 p -87.69 -36.97 17.1 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.233 -0.439 . . . . 73.32 111.231 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.924 0 CA-C-N 116.28 -0.418 . . . . 71.0 112.517 -176.915 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.588 0 N-CA-C 113.487 0.155 . . . . 74.43 113.487 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.577 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -74.84 -52.21 11.97 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.405 0.521 . . . . 63.52 112.405 -174.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.1 m -59.13 -51.34 70.45 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 120.947 0.403 . . . . 74.23 111.443 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.7 m -60.48 -32.69 71.66 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.337 -0.392 . . . . 74.52 111.65 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -69.14 -48.64 61.83 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.017 0.436 . . . . 73.11 110.881 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 26.3 mtpp -56.59 -48.37 77.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.427 0.632 . . . . 70.55 110.667 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.71 77.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.758 -0.655 . . . . 73.42 111.9 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -54.8 -52.84 61.38 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.297 0.48 . . . . 73.1 112.297 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.41 -42.25 98.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.671 0.272 . . . . 61.25 111.366 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.481 ' O ' HG21 ' A' ' 47' ' ' VAL . 95.6 m -63.95 -35.45 80.74 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.755 -0.202 . . . . 64.02 111.484 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 41.6 mt -53.91 -52.11 61.59 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.625 0.25 . . . . 74.32 111.673 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -77.24 -29.36 53.99 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.198 -0.314 . . . . 74.42 111.758 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.401 ' NH1' HG13 ' A' ' 152' ' ' VAL . 42.2 ttm180 -61.54 -44.45 97.02 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.421 -0.354 . . . . 72.03 111.56 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 43' ' ' THR . 22.3 m -93.78 -33.27 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.143 0.497 . . . . 73.02 111.135 176.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.507 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -56.82 -59.48 10.75 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.706 -0.679 . . . . 53.33 113.271 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.542 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 24.6 t70 -53.12 -34.01 54.86 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 117.322 0.561 . . . . 53.44 111.406 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.3 -49.33 75.45 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.216 -0.516 . . . . 44.32 112.598 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.62 -37.07 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-O 120.817 0.341 . . . . 72.41 111.464 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.8 mt-30 -56.92 -52.1 66.49 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.398 -0.365 . . . . 75.3 111.263 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 34.6 mmm-85 -62.09 -27.95 69.28 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.987 0.365 . . . . 64.03 111.987 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-20 -72.05 -41.95 66.84 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.373 0.606 . . . . 74.12 110.763 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -85.19 -15.67 42.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.499 -0.773 . . . . 61.33 112.582 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 52' ' ' GLN . 43.3 tt0 -47.32 -44.98 24.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.305 0.642 . . . . 75.51 112.717 -170.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.6 t -55.55 -42.56 74.81 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.952 0.406 . . . . 73.4 111.737 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.86 -48.28 32.25 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.795 0.331 . . . . 51.01 111.794 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -57.49 -44.11 84.69 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.559 -0.291 . . . . 72.12 111.749 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -55.01 -39.65 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.121 0.486 . . . . 75.41 110.835 174.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -63.77 -28.74 73.07 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-N 116.055 -0.521 . . . . 55.01 112.787 176.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 82.7 mtp -79.09 -47.98 15.15 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.094 0.473 . . . . 74.21 110.687 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.63 -34.84 73.3 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.294 0.479 . . . . 75.12 112.294 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.0 ptt180 -67.79 -16.7 64.24 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 111.968 0.359 . . . . 62.41 111.968 -178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 11.27 22.49 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.087 0.47 . . . . 71.45 111.161 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 -73.66 0.64 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.026 -0.534 . . . . 73.1 111.221 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 70.45 -43.86 0.56 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 113.766 1.024 . . . . 73.12 113.766 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.441 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.5 mp 62.83 90.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.445 0.64 . . . . 64.15 111.026 -174.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -12.6 33.13 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.975 -0.557 . . . . 75.42 111.935 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.23 175.28 13.61 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.359 0.599 . . . . 73.12 112.274 176.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.553 ' HG2' ' HZ1' ' A' ' 75' ' ' LYS . 36.7 tt0 -57.08 -35.26 69.17 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.678 -0.692 . . . . 63.41 112.71 -177.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -62.58 -29.2 70.42 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.279 0.474 . . . . 75.22 112.279 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -66.68 -41.45 88.08 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.076 0.465 . . . . 62.55 110.144 174.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.3 t -57.37 -39.95 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.017 -0.538 . . . . 64.23 110.525 174.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.553 ' HZ1' ' HG2' ' A' ' 71' ' ' GLU . 63.1 mttp -59.17 -42.05 89.88 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.168 0.509 . . . . 63.12 110.628 173.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.5 t -67.8 -35.83 79.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.028 -0.533 . . . . 72.4 111.745 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -55.78 -30.63 61.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.658 0.266 . . . . 74.02 111.523 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.448 ' O ' HG13 ' A' ' 82' ' ' ILE . 22.6 t -52.94 -37.41 60.95 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.009 0.433 . . . . 74.12 111.131 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -59.69 -49.11 79.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.112 0.482 . . . . 70.12 111.104 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.28 -41.46 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.97 -0.559 . . . . 65.44 110.996 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.405 ' SD ' HD11 ' A' ' 98' ' ' LEU . 22.4 mmt -58.04 -37.78 75.02 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.951 -0.568 . . . . 63.35 111.464 178.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 78' ' ' SER . 80.1 mt -63.42 -38.12 81.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 120.845 0.355 . . . . 75.14 111.045 173.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -62.23 -33.42 74.55 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.669 0.271 . . . . 73.53 111.613 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.519 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 95.7 t -56.27 -34.64 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-O 120.988 0.423 . . . . 74.21 111.442 177.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.481 ' CZ ' HD21 ' A' ' 98' ' ' LEU . 74.2 m-85 . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 112.563 0.579 . . . . 72.41 112.563 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.5 m95 . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 113.182 0.808 . . . . 73.13 113.182 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.78 -37.76 70.5 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 121.189 -0.529 . . . . 74.04 113.061 177.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.519 ' HD3' ' O ' ' A' ' 84' ' ' VAL . 3.7 mmp_? -61.6 -36.78 81.66 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.77 0.319 . . . . 71.23 111.781 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.01 -44.89 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.121 0.486 . . . . 74.03 110.723 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -58.41 -49.64 81.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.037 -0.529 . . . . 74.34 111.055 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.4 m -57.05 -47.66 80.42 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.796 0.331 . . . . 71.41 111.49 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.481 HD21 ' CZ ' ' A' ' 85' ' ' PHE . 31.6 tp -58.65 -55.77 30.85 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.193 0.52 . . . . 62.44 112.068 -178.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.469 HG23 ' CD2' ' A' ' 16' ' ' TYR . 41.4 mt -70.46 -34.82 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 116.188 -0.46 . . . . 71.43 111.587 -174.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.5 m -66.54 -41.9 88.01 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.764 -0.198 . . . . 73.44 111.38 177.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.7 t80 -62.16 -43.8 98.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.705 0.288 . . . . 63.32 110.691 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.98 -45.57 86.47 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.891 -0.671 . . . . 70.13 112.375 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.539 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.83 -33.78 76.36 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.844 0.354 . . . . 73.21 111.816 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -65.61 -43.27 90.09 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.96 0.41 . . . . 73.24 110.54 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 101' ' ' PHE . 48.9 t -65.91 -38.47 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-O 120.851 0.358 . . . . 65.12 110.439 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.63 -41.2 69.76 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.185 -0.462 . . . . 64.21 111.865 177.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -54.34 -48.91 70.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.528 0.68 . . . . 71.32 110.619 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.466 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.4 t60 -67.05 -39.71 86.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.76 -0.655 . . . . 74.22 111.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -58.65 -50.14 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.737 0.303 . . . . 65.41 111.331 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.57 -45.95 90.33 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.084 0.469 . . . . 72.13 111.035 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 63.2 m -55.68 -40.23 72.02 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.937 -0.574 . . . . 64.44 112.231 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.4 pt -96.57 21.2 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.507 0.558 . . . . 64.21 112.507 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 69.16 10.43 7.84 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.832 0.679 . . . . 65.2 112.832 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -92.12 27.45 2.17 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.024 0.44 . . . . 73.22 110.589 175.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.483 ' HG3' HD12 ' A' ' 118' ' ' ILE . 70.8 tt0 -58.93 -34.86 72.21 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.342 0.497 . . . . 72.15 112.342 -174.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.9 m -56.92 -31.98 65.47 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.927 0.394 . . . . 75.52 111.195 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -64.74 -26.37 68.33 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.396 0.517 . . . . 74.32 112.396 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.483 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.0 mt -53.67 -41.22 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 112.725 0.639 . . . . 72.54 112.725 -176.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.04 -54.64 9.44 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 112.403 0.519 . . . . 74.24 112.403 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.13 -29.34 86.93 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 121.712 1.608 . . . . 75.13 112.263 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.7 tt -65.01 -46.39 81.55 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.867 -0.42 . . . . 75.04 109.867 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -56.93 -40.78 77.01 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.819 173.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.522 ' HG2' HD13 ' A' ' 10' ' ' LEU . 42.1 mt-10 -63.98 -32.87 74.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.095 -0.502 . . . . 73.23 111.162 177.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.0 m -68.01 -38.64 82.84 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.59 0.234 . . . . 72.44 111.186 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -58.34 -53.27 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.227 0.537 . . . . 75.44 110.405 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 61.0 m -64.11 -35.15 79.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.838 -0.619 . . . . 74.03 111.203 176.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 23.3 t70 -59.97 -52.58 64.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.536 0.199 . . . . 74.5 111.536 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 96.3 t -63.65 -45.46 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.14 0.495 . . . . 63.45 110.651 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.55 ' HG ' HD11 ' A' ' 137' ' ' LEU . 46.4 tp -51.58 -52.13 49.83 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.785 -0.643 . . . . 75.54 111.079 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.529 HG12 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -69.36 -37.04 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.89 -0.595 . . . . 70.32 111.836 177.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.4 tpt180 -58.4 -35.89 72.71 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.17 -0.468 . . . . 72.03 112.151 -174.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.6 t -123.26 -16.74 6.82 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.365 0.876 . . . . 74.43 113.365 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -132.39 16.49 4.48 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.965 1.098 . . . . 72.33 113.965 -172.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.551 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.7 ttp180 -60.33 -50.8 72.17 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.786 0.721 . . . . 75.15 111.304 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 30.7 t70 -55.64 -44.74 77.43 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.061 0.458 . . . . 75.02 110.653 177.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -63.34 -36.59 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.366 -0.379 . . . . 74.31 111.867 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.55 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.0 mt -57.0 -50.44 72.71 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.679 0.276 . . . . 72.44 111.275 174.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -77.8 -32.28 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 112.546 0.573 . . . . 74.33 112.546 -177.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.6 mmtt -72.36 -51.9 18.5 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.069 -0.395 . . . . 70.03 111.585 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -86.1 -9.33 56.89 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.467 -0.333 . . . . 73.41 111.762 -177.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mtt-85 61.61 60.16 1.69 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.403 0.621 . . . . 71.54 110.124 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -48.06 -49.62 23.62 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 115.1 -0.954 . . . . 53.22 115.354 -171.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -69.07 -43.19 75.08 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 117.428 0.614 . . . . 74.24 112.046 -174.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.5 -32.8 73.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.212 0.529 . . . . 64.54 110.83 174.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.519 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -74.3 -30.53 60.51 Favored Glycine 0 CA--C 1.525 0.66 0 CA-C-N 116.002 -0.544 . . . . 71.21 112.74 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -57.33 -42.94 82.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 73.31 111.133 177.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.484 HG12 ' HE3' ' A' ' 39' ' ' LYS . 30.8 t -68.03 -42.17 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 115.926 -0.579 . . . . 74.31 111.781 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.519 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.9 pt-20 -71.82 -32.1 67.23 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.655 0.264 . . . . 73.43 111.518 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.67 -49.36 78.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.853 0.359 . . . . 74.33 111.523 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -83.58 -1.8 54.64 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.819 0.303 . . . . 75.43 111.819 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 37.3 t60 59.66 21.91 10.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.741 0.416 . . . . 74.21 111.915 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.401 HG13 ' NH1' ' A' ' 46' ' ' ARG . 94.6 t . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 120.976 0.417 . . . . 74.2 112.089 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 113.349 0.87 . . . . 73.44 113.349 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.48 -44.45 80.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.336 -0.847 . . . . 73.43 110.702 173.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.418 HD13 ' HB3' ' A' ' 137' ' ' LEU . 60.0 tp -54.69 -43.71 72.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.838 -0.619 . . . . 65.34 111.782 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -68.31 -50.4 53.72 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.813 0.34 . . . . 72.04 111.365 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -63.55 -37.84 88.83 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.096 0.406 . . . . 74.41 112.096 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -69.44 -52.25 28.52 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.425 -0.352 . . . . 74.33 111.189 178.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -59.44 -51.86 68.08 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.716 0.293 . . . . 74.53 111.285 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.3 -45.0 65.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.284 -0.416 . . . . 74.31 111.689 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.518 ' HG2' ' HD2' ' A' ' 15' ' ' ARG . 28.2 tt0 -62.79 -51.56 66.62 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.72 0.295 . . . . 64.45 111.228 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 8' ' ' GLN . 72.0 mt -55.24 -48.76 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.072 0.463 . . . . 63.33 111.444 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.453 ' O ' HD11 ' A' ' 17' ' ' LEU . 75.9 mt -64.04 -50.27 77.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 116.117 -0.492 . . . . 73.31 111.571 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 28.7 t -53.62 -54.23 40.57 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.812 0.339 . . . . 74.41 111.769 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.518 ' HD2' ' HG2' ' A' ' 11' ' ' GLU . 55.0 mtp180 -58.06 -50.29 73.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.299 -0.409 . . . . 75.34 111.386 -178.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.64 -47.45 73.49 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.796 0.331 . . . . 70.34 111.444 177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.453 HD11 ' O ' ' A' ' 13' ' ' ILE . 8.3 mp -59.11 -45.45 90.87 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.781 0.289 . . . . 73.43 111.781 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.4 mmm180 -62.58 -53.06 60.22 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.652 0.263 . . . . 72.53 111.217 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.523 ' OE2' ' HD3' ' A' ' 45' ' ' ARG . 10.1 pt-20 -64.86 -35.02 79.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.832 0.349 . . . . 73.34 111.889 -178.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.48 ' HG2' ' HB1' ' A' ' 103' ' ' ALA . 8.1 tp-100 -69.5 -25.75 64.2 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.959 0.409 . . . . 73.2 111.121 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.71 -31.29 21.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.122 0.416 . . . . 71.33 112.122 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 18' ' ' ARG . 66.4 p -87.71 -37.75 16.41 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.191 0.441 . . . . 73.54 112.191 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.98 0 CA-C-N 116.216 -0.447 . . . . 65.25 112.379 -173.865 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.777 0 N-CA-C 113.701 0.241 . . . . 53.32 113.701 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.71 -50.36 60.67 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.572 0.582 . . . . 55.11 112.572 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.2 m -55.17 -51.62 65.92 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.125 0.417 . . . . 71.45 112.125 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.6 m -60.61 -42.44 96.81 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.921 0.341 . . . . 74.22 111.921 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.79 -42.08 96.86 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.046 0.451 . . . . 73.43 110.891 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -64.34 -43.64 93.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.892 -0.595 . . . . 70.2 111.408 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.51 -55.12 37.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.764 0.316 . . . . 71.01 111.538 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.2 tp -54.7 -41.68 70.57 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.204 0.526 . . . . 75.14 110.973 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -62.5 -47.14 85.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.818 -0.628 . . . . 72.51 111.479 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 89.2 m -61.87 -41.39 97.79 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.134 -0.484 . . . . 74.41 111.521 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.3 mt -53.6 -33.67 55.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.181 0.438 . . . . 71.01 112.181 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.523 ' HD3' ' OE2' ' A' ' 19' ' ' GLU . 42.7 mtm-85 -72.75 -55.29 6.98 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.855 0.317 . . . . 70.35 111.855 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -63.1 -37.19 86.23 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.819 0.674 . . . . 63.1 112.819 -176.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 43' ' ' THR . 15.5 m -91.96 -31.18 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 O-C-N 122.052 -0.405 . . . . 70.21 111.948 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.52 -43.78 85.32 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 121.291 -0.48 . . . . 42.23 114.061 -175.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -51.7 -53.5 38.52 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 117.0 0.4 . . . . 64.02 111.977 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.82 -46.74 74.98 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 121.105 -0.569 . . . . 70.43 112.864 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.6 t -58.46 -49.16 83.15 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 120.818 0.342 . . . . 74.44 111.117 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -57.12 -44.24 83.09 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.365 -0.38 . . . . 72.3 111.929 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -68.73 -51.07 45.37 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.331 0.493 . . . . 61.32 112.331 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -61.9 -36.81 82.43 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.412 0.625 . . . . 73.2 111.385 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.32 -16.67 57.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.501 -0.772 . . . . 74.33 112.988 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.32 -50.0 22.79 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.911 0.708 . . . . 72.12 112.911 -171.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.9 t -53.81 -40.43 66.36 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.859 0.361 . . . . 61.13 111.791 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.57 -41.33 60.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.724 0.297 . . . . 73.21 111.547 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -62.69 -47.58 83.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.402 -0.363 . . . . 71.45 111.535 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -53.11 -39.02 63.1 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.131 0.491 . . . . 72.12 110.993 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.53 -29.57 69.84 Favored Glycine 0 CA--C 1.528 0.845 0 CA-C-N 115.945 -0.571 . . . . 63.43 113.063 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 63.5 mtm -89.61 -42.11 11.59 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 122.379 -0.483 . . . . 73.44 111.596 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -55.09 -35.51 64.68 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.232 0.456 . . . . 71.2 112.232 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -63.56 -22.05 66.68 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 112.495 0.554 . . . . 74.04 112.495 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.419 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -108.2 10.58 27.86 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.424 0.631 . . . . 72.52 111.21 174.42 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.419 ' HG ' ' HD2' ' A' ' 65' ' ' LYS . 91.6 mt -117.18 -76.18 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.775 -0.648 . . . . 62.04 110.274 175.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.9 t0 71.12 -40.72 0.48 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.287 1.035 . . . . 65.01 113.426 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.546 HD13 HD22 ' A' ' 77' ' ' LEU . 3.0 mp 60.42 94.25 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.975 0.91 . . . . 63.34 112.541 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.76 -10.1 17.66 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.201 -0.454 . . . . 74.34 111.165 176.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.462 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -158.73 169.58 24.07 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.39 -0.368 . . . . 72.15 111.252 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.52 -32.19 66.8 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.171 0.804 . . . . 73.14 113.171 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.21 -33.38 58.14 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.946 0.403 . . . . 74.51 111.722 177.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -71.46 -39.56 70.87 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.015 0.436 . . . . 70.3 110.458 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -58.67 -45.45 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.253 0.549 . . . . 74.15 110.805 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.59 -33.19 73.47 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.195 0.522 . . . . 61.23 111.077 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.6 m -69.21 -29.19 67.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.165 -0.47 . . . . 61.33 111.327 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.546 HD22 HD13 ' A' ' 68' ' ' ILE . 94.0 mt -61.77 -35.39 77.99 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.78 0.324 . . . . 64.14 110.813 174.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -55.47 -39.2 70.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.064 0.459 . . . . 74.01 111.013 175.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -62.3 -41.55 98.61 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.238 -0.437 . . . . 73.43 110.706 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.425 ' O ' HG22 ' A' ' 84' ' ' VAL . 83.7 t -59.35 -43.51 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 120.928 0.394 . . . . 62.24 110.47 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.9 mmt -56.74 -43.61 80.89 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.994 -0.548 . . . . 75.1 111.16 177.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 69.6 mt -59.08 -34.5 53.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.183 0.516 . . . . 70.51 110.964 175.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -73.08 -32.24 64.88 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 116.199 -0.455 . . . . 75.43 111.366 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 80' ' ' VAL . 88.0 t -59.45 -38.38 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-O 120.903 0.383 . . . . 73.11 111.924 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.404 ' CE2' HD22 ' A' ' 98' ' ' LEU . 72.6 m-85 . . . . . 0 N--CA 1.47 0.552 0 N-CA-C 112.192 0.441 . . . . 72.34 112.192 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.448 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 71.8 m95 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 112.033 0.383 . . . . 71.13 112.033 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.34 82.55 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.252 -0.499 . . . . 37.66 112.905 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 94' ' ' ARG . 25.4 mmt180 -70.91 -32.49 69.44 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.464 -0.433 . . . . 74.22 111.117 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.3 mm -62.21 -46.29 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.032 0.444 . . . . 72.24 110.546 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -57.41 -48.25 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 116.129 -0.487 . . . . 74.33 110.869 174.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.1 m -56.55 -43.27 79.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.247 -0.433 . . . . 73.43 111.654 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.411 HD11 ' SD ' ' A' ' 81' ' ' MET . 33.5 tp -59.3 -55.23 37.51 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.211 0.529 . . . . 72.24 111.652 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.1 mt -68.84 -34.08 62.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.071 -0.513 . . . . 75.33 111.449 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -64.91 -45.17 86.99 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.466 -0.333 . . . . 72.52 111.409 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -62.16 -43.06 99.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.77 0.319 . . . . 75.25 110.651 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -46.45 92.03 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.872 -0.68 . . . . 37.66 112.417 175.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.48 ' HB1' ' HG2' ' A' ' 20' ' ' GLN . . . -66.73 -31.95 72.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.076 0.465 . . . . 65.35 111.951 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.19 -48.44 70.65 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.833 0.349 . . . . 74.04 110.571 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.464 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.9 t -65.44 -36.48 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.884 0.373 . . . . 74.43 110.573 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.34 -43.75 67.95 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.065 -0.516 . . . . 74.22 111.728 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -54.57 -49.54 70.09 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.149 0.5 . . . . 71.1 110.771 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.47 ' O ' HG12 ' A' ' 112' ' ' ILE . 79.1 t60 -60.87 -40.19 92.03 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.037 -0.529 . . . . 74.41 111.36 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 88.2 mt -62.17 -50.46 71.76 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.715 0.293 . . . . 74.45 111.658 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.449 ' HE3' HG21 ' A' ' 22' ' ' THR . 61.0 tttm -62.89 -33.53 75.49 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.201 0.524 . . . . 75.34 111.212 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.9 m -64.14 -45.38 88.77 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.196 -0.456 . . . . 72.33 111.721 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.503 HG13 ' HG2' ' A' ' 114' ' ' GLN . 47.2 pt -90.33 24.64 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 N-CA-C 112.674 0.62 . . . . 74.41 112.674 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 69.28 12.49 8.4 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.848 0.685 . . . . 72.05 112.848 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.503 ' HG2' HG13 ' A' ' 112' ' ' ILE . 13.6 mm100 -99.61 36.99 1.67 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.071 -0.393 . . . . 70.04 111.633 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.89 -32.81 69.84 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.794 0.331 . . . . 71.2 111.492 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.419 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 52.4 m -53.79 -41.42 67.22 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.93 0.395 . . . . 65.4 111.344 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.47 ' HG ' ' HB3' ' A' ' 114' ' ' GLN . 53.1 m -56.9 -27.41 60.68 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.844 0.683 . . . . 74.12 112.844 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 63.9 mt -57.77 -33.55 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 112.203 0.446 . . . . 74.12 112.203 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.79 -54.61 6.15 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 112.481 0.549 . . . . 72.4 112.481 -177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.419 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.5 Cg_endo -59.52 -26.38 81.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.518 1.479 . . . . 72.12 111.799 172.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 109' ' ' LEU . 6.5 tt -66.19 -46.13 78.37 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.661 -0.496 . . . . 74.53 109.661 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.14 -44.58 87.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.252 -0.431 . . . . 75.11 110.802 174.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -58.82 -39.48 81.3 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.4 -0.364 . . . . 71.33 111.176 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -61.67 -41.83 98.09 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.918 0.39 . . . . 62.1 111.006 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 39.7 mm -60.79 -54.1 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-O 121.126 0.489 . . . . 74.53 110.984 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.2 m -68.18 -33.64 74.82 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.104 -0.498 . . . . 72.21 112.084 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.8 t70 -61.03 -52.46 64.9 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.283 -0.261 . . . . 64.54 110.788 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.467 HG22 ' HB2' ' A' ' 81' ' ' MET . 80.4 t -64.51 -39.3 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.141 0.496 . . . . 75.45 110.975 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.522 ' HG ' HD13 ' A' ' 137' ' ' LEU . 45.3 tp -58.93 -53.49 57.8 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.012 -0.54 . . . . 72.43 111.68 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.4 HG12 ' HB2' ' A' ' 134' ' ' ARG . 89.8 t -76.34 -33.79 24.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 111.955 0.354 . . . . 65.22 111.955 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 17.1 tpp180 -53.14 -33.36 52.11 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.246 0.461 . . . . 73.34 112.246 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.49 -28.75 2.04 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.679 0.992 . . . . 65.41 113.679 -175.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -104.31 9.4 35.93 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 112.757 0.651 . . . . 74.24 112.757 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.4 ' HB2' HG12 ' A' ' 130' ' ' VAL . 20.3 ttt180 -50.83 -53.35 32.91 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 121.091 0.472 . . . . 71.52 112.245 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.35 -47.94 74.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 65.31 111.985 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.45 -36.83 85.05 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.279 -0.263 . . . . 74.12 111.463 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.522 HD13 ' HG ' ' A' ' 129' ' ' LEU . 73.3 mt -57.05 -51.0 71.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.75 0.309 . . . . 70.21 111.507 176.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.5 p -77.96 -40.8 27.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 112.512 0.56 . . . . 73.32 112.512 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -63.0 -57.34 11.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.255 0.465 . . . . 72.13 112.255 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -84.88 -3.9 58.88 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.711 0.291 . . . . 75.25 111.324 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 62.29 89.71 0.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.382 0.611 . . . . 63.54 110.535 -173.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . 0.448 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -58.97 -62.24 6.45 Favored Glycine 0 CA--C 1.521 0.438 0 CA-C-N 115.656 -0.702 . . . . 74.0 114.219 -170.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -71.55 -16.6 62.32 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.168 0.433 . . . . 73.32 112.168 -173.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -80.52 -58.08 3.28 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.989 0.423 . . . . 75.04 110.806 173.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.411 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -60.47 -34.78 86.93 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.876 -0.602 . . . . 65.3 113.1 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -54.81 -49.3 71.34 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.963 0.505 . . . . 75.13 111.508 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.66 -42.6 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.173 -0.467 . . . . 72.31 112.222 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.411 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.5 pt-20 -73.34 -27.76 61.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 111.92 0.341 . . . . 75.44 111.92 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -63.69 -45.75 88.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.182 0.515 . . . . 74.45 110.874 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -81.85 3.43 26.08 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.231 -0.441 . . . . 72.51 111.558 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 2.0 t60 58.91 37.32 24.72 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.065 0.546 . . . . 54.24 112.057 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 CA--C 1.542 0.65 0 CA-C-O 120.953 0.406 . . . . 64.41 111.772 -179.388 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.4 t70 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 110.439 -0.208 . . . . 74.21 110.439 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.29 -42.58 91.62 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.684 0.278 . . . . 74.04 110.427 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.92 -40.61 70.04 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.022 0.439 . . . . 65.11 110.975 177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -67.65 -39.6 84.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.154 -0.475 . . . . 73.23 110.999 176.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -67.65 -51.25 52.19 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.175 0.435 . . . . 63.34 112.175 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.513 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -52.23 -52.04 54.76 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.755 0.312 . . . . 73.13 111.382 175.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.4 p -63.98 -54.63 31.38 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 111.954 0.353 . . . . 60.31 111.954 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.7 tp -52.89 -45.48 67.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.232 0.456 . . . . 72.22 112.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -62.55 -45.46 92.83 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 120.681 0.277 . . . . 73.3 111.248 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 8' ' ' GLN . 86.0 mt -57.63 -51.34 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.243 0.544 . . . . 74.41 111.093 176.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.44 ' O ' HD13 ' A' ' 17' ' ' LEU . 77.8 mt -61.34 -47.87 91.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 115.759 -0.655 . . . . 65.23 111.486 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.432 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 41.8 t -54.35 -50.35 67.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.976 0.417 . . . . 70.41 111.467 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.424 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 35.2 mtp180 -61.33 -48.35 81.7 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.362 -0.381 . . . . 74.2 111.621 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.469 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 32.1 t80 -53.4 -48.78 68.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.879 0.371 . . . . 65.02 111.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.5 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.3 mp -59.61 -42.74 93.33 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.662 0.268 . . . . 73.15 111.421 175.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 14' ' ' SER . 37.2 mmt180 -60.39 -43.9 96.21 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.65 0.262 . . . . 70.13 111.429 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 81.1 mt-10 -63.98 -42.63 97.18 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.009 0.433 . . . . 74.42 111.488 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 27.7 mm-40 -71.99 -26.07 62.09 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.07 0.396 . . . . 75.53 112.07 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.408 ' O ' ' HD3' ' A' ' 110' ' ' LYS . . . -84.82 -44.39 13.31 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.33 0.492 . . . . 64.14 112.33 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -87.62 -30.19 20.65 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.017 0.377 . . . . 75.31 112.017 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.889 0 C-N-CA 121.338 -0.458 . . . . 55.42 112.876 -176.684 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.79 0 N-CA-C 112.987 -0.045 . . . . 71.45 112.987 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.458 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . . . -54.31 -39.13 66.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.794 0.33 . . . . 74.5 111.576 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.6 m -54.69 -52.33 62.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.06 0.457 . . . . 71.35 111.576 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 59.6 p -67.36 -31.13 71.17 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.842 0.353 . . . . 64.12 111.856 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 38' ' ' ARG . 1.1 tmm_? -66.49 -53.39 35.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.305 0.574 . . . . 73.32 110.143 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HE2' ' HB3' ' A' ' 35' ' ' ALA . 63.3 mttm -60.95 -39.32 89.04 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.625 -0.716 . . . . 61.03 111.268 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.86 -47.46 82.64 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.409 -0.36 . . . . 74.02 111.706 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.38 -52.62 63.86 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 111.846 0.313 . . . . 72.45 111.846 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.97 -39.77 90.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.771 0.319 . . . . 75.4 111.226 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.553 ' O ' HG22 ' A' ' 47' ' ' VAL . 63.7 m -66.15 -50.06 65.26 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.562 0.22 . . . . 62.54 110.818 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.9 mt -53.99 -45.18 71.36 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.258 0.466 . . . . 64.14 112.258 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HA ' ' CE1' ' A' ' 16' ' ' TYR . 5.0 ptm180 -73.97 -39.03 63.98 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 111.784 0.29 . . . . 72.41 111.784 -176.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -71.97 -35.16 69.46 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.296 -0.253 . . . . 74.43 111.679 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 43' ' ' THR . 17.6 m -87.92 -33.47 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.043 0.449 . . . . 64.44 111.366 177.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -64.3 -42.31 97.85 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-N 116.24 -0.437 . . . . 71.05 113.507 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -54.5 -42.74 71.11 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.912 0.386 . . . . 72.32 111.425 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.6 -43.65 91.64 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.104 -0.569 . . . . 70.3 112.618 176.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.431 ' HA ' HD22 ' A' ' 54' ' ' ASN . 97.3 t -59.62 -41.17 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 120.709 0.29 . . . . 65.21 111.318 177.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 78.9 mt-30 -57.96 -41.42 82.85 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.565 -0.289 . . . . 60.5 111.573 178.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 16.1 mmm-85 -61.98 -56.1 22.62 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.575 0.583 . . . . 71.24 112.575 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.431 HD22 ' HA ' ' A' ' 51' ' ' VAL . 9.6 p30 -70.81 -21.84 62.42 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.031 -0.418 . . . . 51.4 111.785 -177.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -90.46 -20.47 22.7 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.514 0.561 . . . . 73.52 112.514 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -50.08 -49.57 50.95 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.729 0.64 . . . . 72.33 112.729 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -58.93 -34.01 71.24 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.852 0.358 . . . . 75.24 111.859 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.1 -43.83 23.29 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.889 0.376 . . . . 74.34 111.718 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -64.56 -39.65 94.13 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.483 -0.326 . . . . 71.2 111.373 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -53.0 -41.53 64.72 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.0 0.429 . . . . 74.21 110.816 173.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -62.74 -27.0 69.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 115.904 -0.589 . . . . 73.01 112.958 175.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.562 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 81.5 mtp -81.4 -51.42 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 122.637 -0.331 . . . . 74.51 110.97 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.9 mp -55.0 -37.44 66.6 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.542 0.571 . . . . 71.25 112.542 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -66.41 -25.43 66.76 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 111.978 0.362 . . . . 73.11 111.978 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -96.31 -16.18 21.49 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 122.106 -0.371 . . . . 73.05 110.877 175.422 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.31 -68.26 0.71 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.375 -0.375 . . . . 73.33 111.16 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 54.37 97.71 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.389 0.614 . . . . 63.34 111.938 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.507 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.3 mp -93.1 100.58 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.157 0.503 . . . . 62.51 111.19 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.27 -6.58 17.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.174 -0.466 . . . . 74.14 112.147 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -155.42 174.85 14.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.825 0.345 . . . . 75.14 111.37 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.4 -37.37 83.2 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.289 0.477 . . . . 75.3 112.289 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.27 -39.19 66.65 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.788 0.327 . . . . 75.34 111.487 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.478 ' HB2' HG21 ' A' ' 68' ' ' ILE . 48.1 m-20 -63.75 -38.28 90.5 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.066 0.46 . . . . 71.03 110.916 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.38 -46.08 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.337 0.589 . . . . 75.1 110.844 175.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 78' ' ' SER . 98.2 mttt -70.0 -23.93 63.22 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.137 -0.483 . . . . 72.11 111.223 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.2 t -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.074 0.464 . . . . 74.53 110.403 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.518 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.5 mt -57.2 -37.93 72.93 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.345 -0.388 . . . . 62.03 110.464 174.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.446 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 38.5 t -53.25 -37.9 62.51 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.469 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -40.27 97.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.197 0.522 . . . . 74.33 110.54 177.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.448 ' HA ' ' CD2' ' A' ' 83' ' ' HIS . 61.5 t -66.94 -39.79 84.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.072 -0.513 . . . . 64.43 110.647 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.536 ' HB3' HD12 ' A' ' 98' ' ' LEU . 21.4 mmt -55.39 -40.51 71.48 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.864 -0.607 . . . . 73.2 111.211 177.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 78' ' ' SER . 73.7 mt -60.74 -33.55 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 116.078 -0.51 . . . . 75.43 111.349 174.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.448 ' CD2' ' HA ' ' A' ' 80' ' ' VAL . 27.1 m-70 -72.8 -28.86 62.82 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.516 -0.311 . . . . 65.24 111.687 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 92.2 t -58.02 -28.84 34.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 121.064 0.459 . . . . 71.21 111.711 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.482 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 74.0 m-85 . . . . . 0 CA--C 1.543 0.674 0 N-CA-C 112.853 0.686 . . . . 75.51 112.853 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.48 ' HE3' HG13 ' A' ' 95' ' ' ILE . 81.8 m95 . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 112.525 0.565 . . . . 75.35 112.525 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.1 -31.59 73.42 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.189 -0.529 . . . . 71.1 112.786 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.482 ' HD2' ' HA ' ' A' ' 85' ' ' PHE . 65.8 mtm180 -66.23 -36.2 82.39 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.393 -0.475 . . . . 71.41 111.188 175.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.48 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.4 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.134 0.492 . . . . 74.2 110.501 176.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.19 -49.91 81.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.115 -0.493 . . . . 60.35 111.178 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.8 m -56.01 -41.96 75.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.39 -0.368 . . . . 75.34 111.473 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.536 HD12 ' HB3' ' A' ' 81' ' ' MET . 35.9 tp -61.33 -55.1 35.45 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.27 0.557 . . . . 74.44 111.896 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.0 mt -72.04 -35.26 53.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 116.14 -0.482 . . . . 73.53 111.955 -174.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.2 p -64.7 -44.89 88.81 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.581 0.229 . . . . 63.33 111.044 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -60.26 -41.32 93.01 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.797 0.332 . . . . 74.33 110.991 176.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.71 -43.83 94.33 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.858 -0.686 . . . . 62.44 112.468 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.5 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.14 -35.18 79.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.981 0.42 . . . . 74.22 111.439 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -62.44 -42.61 99.59 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.229 -0.441 . . . . 75.24 111.018 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.428 ' HB ' HD12 ' A' ' 121' ' ' LEU . 47.3 t -71.46 -38.3 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.737 0.303 . . . . 73.14 110.863 175.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.97 73.33 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.345 0.498 . . . . 55.13 112.345 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.43 -36.16 79.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.111 0.481 . . . . 72.44 110.925 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -68.58 -34.72 76.3 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.376 -0.375 . . . . 74.04 110.89 176.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.472 HD13 HD11 ' A' ' 121' ' ' LEU . 90.0 mt -62.63 -50.36 71.55 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.639 0.257 . . . . 63.22 111.073 177.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 56.6 tttm -61.74 -35.14 77.23 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.905 0.383 . . . . 74.4 111.041 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.2 m -60.48 -41.14 93.62 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.414 -0.357 . . . . 73.54 111.491 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.4 pt -92.94 18.88 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.864 0.364 . . . . 74.11 111.876 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 67.59 16.21 9.85 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.182 0.808 . . . . 73.41 113.182 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.502 ' HB3' ' HG ' ' A' ' 117' ' ' SER . 14.9 mm100 -91.95 40.84 1.05 Allowed 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.96 0.409 . . . . 73.23 110.795 173.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.98 -40.8 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.017 0.527 . . . . 71.34 111.812 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 88.3 p -62.94 -33.59 75.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.027 0.38 . . . . 75.31 112.027 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.502 ' HG ' ' HB3' ' A' ' 114' ' ' GLN . 49.4 m -58.24 -26.11 62.5 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.353 0.501 . . . . 72.41 112.353 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 70.0 mt -54.38 -36.03 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 112.295 0.48 . . . . 62.43 112.295 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -67.08 -58.3 9.45 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 112.331 0.493 . . . . 73.42 112.331 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -57.32 -28.68 81.04 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.634 1.556 . . . . 50.14 112.092 175.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.472 HD11 HD13 ' A' ' 109' ' ' LEU . 5.0 tt -64.41 -50.45 67.55 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 110.008 -0.368 . . . . 72.11 110.008 175.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.28 76.21 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.174 0.511 . . . . 63.44 111.137 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.77 -29.19 67.52 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.325 -0.398 . . . . 71.02 111.594 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.0 m -69.34 -43.52 73.51 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.843 0.354 . . . . 74.31 111.089 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.426 HG22 ' HG ' ' A' ' 98' ' ' LEU . 44.6 mm -55.73 -52.92 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.367 0.603 . . . . 65.22 110.43 174.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.4 m -65.43 -35.97 82.52 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.419 -0.81 . . . . 74.44 111.666 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.9 t70 -57.53 -52.54 64.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.733 0.302 . . . . 74.53 110.996 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.541 ' O ' HG23 ' A' ' 132' ' ' THR . 62.1 t -64.36 -42.8 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 120.937 0.399 . . . . 73.1 111.053 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.523 ' HG ' HD13 ' A' ' 137' ' ' LEU . 44.1 tp -53.89 -52.84 59.24 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.335 0.588 . . . . 73.0 111.351 178.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.76 -30.74 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.856 -0.611 . . . . 72.32 111.376 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.1 tpt180 -57.47 -49.69 75.47 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.121 0.486 . . . . 64.14 112.179 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.541 HG23 ' O ' ' A' ' 128' ' ' VAL . 2.9 t -104.39 -29.56 10.66 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.906 1.076 . . . . 70.52 113.906 -172.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -130.47 22.44 5.13 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.081 1.141 . . . . 74.5 114.081 -171.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.493 ' HA ' HD12 ' A' ' 137' ' ' LEU . 33.8 ttp180 -54.47 -43.35 71.64 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-O 121.011 0.434 . . . . 71.13 111.983 175.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.405 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 33.8 t70 -58.65 -49.58 77.0 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.21 -0.45 . . . . 65.31 111.525 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.46 -35.74 81.82 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.774 0.287 . . . . 72.42 111.774 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.523 HD13 ' HG ' ' A' ' 129' ' ' LEU . 55.9 mt -51.81 -48.45 63.87 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.661 0.267 . . . . 72.32 111.501 174.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.79 -31.85 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 112.446 0.536 . . . . 63.14 112.446 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 45.1 mmtm -65.47 -64.33 0.89 Allowed 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.965 -0.46 . . . . 71.33 112.186 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -85.6 4.02 38.11 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.419 -0.355 . . . . 75.25 111.247 -176.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 51.49 72.17 0.39 Allowed 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.231 0.539 . . . . 72.23 110.084 -172.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.33 -50.29 6.63 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.218 -0.901 . . . . 70.01 114.793 -171.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.437 ' O ' HG22 ' A' ' 147' ' ' VAL . 40.5 m95 -72.95 -26.26 61.32 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.32 0.489 . . . . 74.53 112.32 -175.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -76.42 -53.93 7.45 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.279 0.562 . . . . 72.24 110.587 173.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.444 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -58.39 -33.64 71.82 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.716 -0.675 . . . . 71.41 112.673 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.56 -45.71 81.13 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.301 0.572 . . . . 74.43 111.58 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.489 HG13 ' HB ' ' A' ' 152' ' ' VAL . 47.2 t -70.26 -42.34 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.941 -0.572 . . . . 65.12 112.026 -177.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.444 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.8 pt-20 -73.34 -27.89 61.76 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.783 0.325 . . . . 74.41 111.36 177.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.89 -48.96 78.16 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.575 0.35 . . . . 71.45 111.675 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -83.21 -10.99 58.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 111.961 0.356 . . . . 71.45 111.961 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 65.75 74.83 0.36 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.197 0.522 . . . . 72.14 111.405 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.489 ' HB ' HG13 ' A' ' 147' ' ' VAL . 59.9 t . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 74.12 110.158 174.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.5 t70 . . . . . 0 CA--C 1.542 0.648 0 CA-C-O 120.755 0.312 . . . . 72.45 110.668 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -55.52 -41.58 73.31 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.891 0.377 . . . . 53.33 111.305 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' A' ' 137' ' ' LEU . 66.6 tp -55.93 -46.79 78.37 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.045 -0.525 . . . . 74.12 110.9 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -62.72 -43.26 99.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.155 -0.475 . . . . 73.0 110.879 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -58.47 -44.63 89.38 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.341 0.497 . . . . 52.11 112.341 177.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.439 ' O ' HG13 ' A' ' 12' ' ' ILE . 47.7 tt0 -73.15 -45.03 59.03 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.707 0.262 . . . . 61.34 111.707 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.0 p -60.91 -53.1 61.45 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.695 0.283 . . . . 62.24 111.148 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.9 tp -54.53 -40.83 69.03 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.379 -0.373 . . . . 65.0 111.559 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.39 -51.64 68.6 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.132 0.491 . . . . 65.01 111.317 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 8' ' ' GLN . 57.2 mt -64.21 -49.75 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.043 -0.526 . . . . 74.11 111.37 -178.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.0 mt -62.32 -47.29 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 116.224 -0.444 . . . . 72.03 111.662 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.524 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 39.3 t -54.66 -54.6 39.57 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.512 -0.313 . . . . 73.43 111.642 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -60.27 -45.84 91.89 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.666 -0.243 . . . . 73.25 111.499 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -56.12 -48.54 76.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.884 0.373 . . . . 72.23 111.555 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.489 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.1 mp -59.39 -41.89 90.44 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.741 -0.209 . . . . 73.44 111.452 176.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.524 ' HG2' ' O ' ' A' ' 14' ' ' SER . 22.1 mmm180 -63.79 -55.36 23.64 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 111.688 0.255 . . . . 73.41 111.688 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.422 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 6.9 pt-20 -61.62 -40.6 95.43 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.015 0.376 . . . . 74.2 112.015 -177.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.7 mm-40 -70.66 -22.74 62.46 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.161 -0.337 . . . . 74.52 111.439 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -80.04 -43.06 22.55 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 111.88 0.326 . . . . 75.32 111.88 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.5 p -87.4 -16.83 33.78 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.924 0.392 . . . . 70.31 111.662 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.699 0 C-N-CA 121.105 -0.569 . . . . 74.11 112.527 -176.569 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.718 0 CA-C-O 120.452 -0.082 . . . . 52.12 113.164 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.38 -49.67 75.44 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.183 0.438 . . . . 73.44 112.183 -176.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.4 m -60.47 -41.06 93.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.092 0.472 . . . . 64.12 111.107 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.3 m -62.99 -42.39 99.83 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.273 -0.422 . . . . 74.34 111.15 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -63.55 -55.95 19.79 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.888 0.375 . . . . 71.53 111.572 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.578 ' HG3' HG21 ' A' ' 147' ' ' VAL . 3.2 ptmm? -63.18 -29.36 70.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.34 -0.391 . . . . 73.21 111.404 -174.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.16 82.36 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.929 0.395 . . . . 74.01 111.06 173.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.2 tp -59.22 -54.39 47.43 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.306 -0.407 . . . . 71.32 111.92 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.37 -24.79 64.83 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.025 0.379 . . . . 75.52 112.025 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.472 HG23 HG23 ' A' ' 152' ' ' VAL . 28.3 m -66.49 -42.52 87.28 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 122.106 -0.371 . . . . 75.45 110.3 169.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.4 mt -56.41 -31.89 64.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.691 0.282 . . . . 70.01 111.513 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -68.76 -54.45 15.94 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.289 0.566 . . . . 61.13 110.68 174.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 24.3 ttt180 -56.46 -44.84 80.91 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.287 -0.869 . . . . 70.13 112.416 -177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 43' ' ' THR . 15.6 m -93.72 -33.08 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.179 0.437 . . . . 74.01 112.179 -178.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.63 -49.52 59.52 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.229 -0.51 . . . . 65.44 113.602 -174.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 14.8 t70 -61.57 -35.99 79.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 117.223 0.512 . . . . 64.31 110.751 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.9 -50.15 70.83 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 121.075 -0.583 . . . . 75.03 112.089 174.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.427 ' HA ' HD22 ' A' ' 54' ' ' ASN . 86.8 t -58.23 -38.46 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.831 0.348 . . . . 74.12 111.192 176.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.4 mt-30 -57.01 -50.56 72.34 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.616 -0.265 . . . . 73.31 111.2 175.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 15.2 mmp_? -55.26 -50.18 70.14 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.904 0.705 . . . . 73.22 112.904 -175.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.427 HD22 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -78.39 -23.1 46.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 112.59 0.589 . . . . 71.42 112.59 -177.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -91.68 -16.96 26.2 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.629 0.603 . . . . 72.1 112.629 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -48.61 -57.95 5.44 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.508 0.929 . . . . 74.03 113.508 -167.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -62.49 -31.36 72.09 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.08 0.466 . . . . 64.11 111.523 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.41 -30.5 67.4 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.988 0.423 . . . . 61.34 111.216 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -76.98 -43.04 36.46 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.422 -0.354 . . . . 72.42 111.224 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -52.05 -40.0 60.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.825 0.345 . . . . 64.12 111.49 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.94 -33.36 56.8 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 121.4 -0.429 . . . . 72.55 113.603 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 67.0 mtm -91.0 -37.29 13.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.494 0.664 . . . . 71.25 110.44 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.44 -38.08 89.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.483 -0.78 . . . . 72.53 111.786 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.72 -39.8 74.55 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.232 -0.44 . . . . 73.05 112.183 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -2.62 58.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.833 0.349 . . . . 74.13 111.636 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.09 -75.7 0.51 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.94 0.4 . . . . 75.01 110.99 174.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 43.34 83.37 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.48 -0.782 . . . . 74.34 111.063 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.567 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.6 mp -60.31 113.61 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.716 -0.675 . . . . 72.51 112.031 -172.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.32 -8.98 18.86 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.986 -0.552 . . . . 61.34 112.155 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.415 HD21 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -166.35 179.75 5.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.911 0.386 . . . . 64.23 111.759 173.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -53.63 -38.8 64.41 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.563 0.579 . . . . 71.1 112.563 -178.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.16 -39.21 63.41 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.825 0.345 . . . . 64.02 111.79 -178.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.522 ' HB2' HG21 ' A' ' 68' ' ' ILE . 21.7 m-20 -69.26 -34.47 74.82 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.947 0.404 . . . . 73.14 110.812 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.55 -39.58 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.271 0.557 . . . . 75.31 110.324 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -62.95 -38.83 92.66 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.174 0.511 . . . . 74.44 110.451 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 45.7 t -62.86 -34.14 76.75 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.095 -0.502 . . . . 62.52 111.33 174.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.485 HD12 HG13 ' A' ' 105' ' ' VAL . 90.4 mt -62.48 -40.01 95.32 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.734 0.302 . . . . 71.24 111.024 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.5 t -52.53 -38.54 59.89 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.176 0.513 . . . . 71.23 111.194 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -58.09 -41.03 82.6 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.051 -0.522 . . . . 73.31 110.894 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.06 -41.29 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 120.951 0.405 . . . . 63.2 110.725 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.2 mmt -54.7 -40.68 69.41 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.992 -0.549 . . . . 73.0 111.241 178.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.31 -32.67 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-O 121.085 0.469 . . . . 71.51 111.313 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -74.31 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 111.829 0.307 . . . . 61.52 111.829 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 67.9 t -57.66 -43.01 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.091 0.472 . . . . 71.34 111.342 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.486 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.2 m-85 . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 121.033 0.444 . . . . 73.52 111.963 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.473 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.6 m95 . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 112.423 0.527 . . . . 72.54 112.423 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.36 -35.78 51.46 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.239 -0.505 . . . . 62.04 113.05 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -56.65 -43.05 79.94 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.942 0.401 . . . . 75.32 111.592 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.473 HG13 ' HE3' ' A' ' 92' ' ' TRP . 43.9 mm -66.68 -43.29 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-O 121.078 0.465 . . . . 72.21 110.322 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.9 t -57.38 -42.32 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.026 -0.534 . . . . 72.04 110.595 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.3 m -57.4 -46.76 83.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 72.42 111.417 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.491 ' HG ' HG22 ' A' ' 125' ' ' ILE . 31.2 tp -58.35 -54.52 46.07 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.142 0.496 . . . . 70.32 111.381 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.2 mt -65.53 -37.96 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.055 -0.52 . . . . 74.03 111.959 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.4 m -63.19 -45.82 89.94 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 116.565 -0.289 . . . . 71.3 111.355 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -65.49 -39.5 91.97 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 120.768 0.318 . . . . 75.54 110.863 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.87 -47.93 85.58 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.962 -0.637 . . . . 54.4 112.377 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.489 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.35 -32.29 73.6 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.854 0.359 . . . . 75.44 111.341 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.436 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 39.0 t80 -63.51 -42.84 98.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.081 0.467 . . . . 53.11 111.12 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.485 HG13 HD12 ' A' ' 77' ' ' LEU . 45.5 t -72.2 -40.47 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.932 0.396 . . . . 72.3 110.674 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.473 ' HB3' HG21 ' A' ' 118' ' ' ILE . . . -58.3 -45.3 88.26 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.139 -0.482 . . . . 74.44 112.291 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 17.1 ptmt -64.12 -32.94 74.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.783 0.325 . . . . 71.3 111.031 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.31 -34.24 75.77 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.748 0.309 . . . . 72.21 110.553 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.567 HD21 ' HB ' ' A' ' 68' ' ' ILE . 92.9 mt -61.82 -49.23 77.12 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.747 0.308 . . . . 72.45 111.148 176.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 8.5 tmtm? -54.29 -44.3 71.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 110.066 -0.346 . . . . 74.33 110.066 176.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.7 m -52.67 -50.53 63.08 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.223 -0.444 . . . . 65.44 111.863 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 38.6 pt -87.29 15.78 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 68.51 18.29 8.95 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.938 0.718 . . . . 73.24 112.938 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -91.66 43.27 1.13 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.011 0.434 . . . . 71.01 111.265 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.91 -17.54 61.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.078 0.399 . . . . 64.41 112.078 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.421 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 72.2 p -71.48 -48.3 50.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.91 0.386 . . . . 73.51 111.012 173.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.45 ' HB2' HD12 ' A' ' 109' ' ' LEU . 24.5 m -56.7 -28.23 60.47 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.061 -0.518 . . . . 73.53 111.991 -177.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.473 HG21 ' HB3' ' A' ' 106' ' ' ALA . 70.9 mt -55.45 -40.95 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 112.639 0.607 . . . . 71.15 112.639 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.06 -53.95 22.75 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 112.203 0.445 . . . . 63.22 112.203 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.421 ' HD2' ' O ' ' A' ' 116' ' ' SER . 23.5 Cg_endo -62.02 -25.04 77.31 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 121.579 1.519 . . . . 64.24 112.438 173.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.422 HD12 HD11 ' A' ' 109' ' ' LEU . 3.9 tt -61.25 -46.48 90.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.698 -0.482 . . . . 74.01 109.698 174.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.05 -33.75 65.28 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.052 0.453 . . . . 64.53 111.439 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -68.18 -39.44 82.51 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.198 -0.455 . . . . 74.42 111.914 177.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 98.3 p -63.35 -47.48 81.95 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.815 0.28 . . . . 63.31 111.099 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.491 HG22 ' HG ' ' A' ' 98' ' ' LEU . 45.9 mm -52.86 -53.23 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.384 0.611 . . . . 74.21 111.028 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.8 m -66.67 -35.83 81.09 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.671 -0.695 . . . . 71.32 111.612 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.6 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 33.3 t70 -61.0 -53.0 62.63 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.755 -0.202 . . . . 72.55 110.912 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.75 -41.42 92.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 120.95 0.405 . . . . 72.53 111.097 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.565 ' HG ' HD13 ' A' ' 137' ' ' LEU . 24.8 tp -52.9 -52.52 57.28 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.284 0.564 . . . . 61.01 111.036 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.2 t -74.16 -35.22 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.97 -0.559 . . . . 55.14 111.576 177.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.6 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.1 ttt180 -54.83 -32.8 60.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.114 0.566 . . . . 73.13 112.106 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.706 HG23 ' HD2' ' A' ' 133' ' ' LYS . 1.6 t -127.1 -18.97 4.46 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 74.43 113.765 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.706 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.3 mptp? -123.68 20.95 9.34 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.17 0.804 . . . . 74.43 113.17 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -45.66 -64.11 0.81 Allowed 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.228 0.537 . . . . 72.11 112.424 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.12 -40.24 93.04 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.742 -0.663 . . . . 73.5 111.826 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -60.04 -42.07 93.62 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 122.239 -0.288 . . . . 71.11 111.61 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.565 HD13 ' HG ' ' A' ' 129' ' ' LEU . 83.3 mt -53.18 -52.53 58.54 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.942 0.401 . . . . 75.21 111.523 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.13 -38.33 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 112.326 0.491 . . . . 53.41 112.326 -176.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -65.11 -40.99 95.3 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.22 0.452 . . . . 70.12 112.22 -177.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -89.76 0.94 56.69 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.352 -0.217 . . . . 74.04 111.576 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 55.16 74.06 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.614 0.721 . . . . 65.42 110.07 -173.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . 0.422 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -53.47 -68.58 1.56 Allowed Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.97 -1.014 . . . . 44.23 115.173 -168.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -67.16 -12.42 59.97 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.156 0.428 . . . . 74.1 112.156 -173.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -84.42 -58.37 2.77 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.993 0.425 . . . . 71.35 110.566 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.541 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -62.58 -30.27 76.12 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.029 -0.532 . . . . 72.42 113.053 178.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -53.96 -47.7 71.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.338 0.589 . . . . 63.01 111.474 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.578 HG21 ' HG3' ' A' ' 39' ' ' LYS . 24.3 t -73.79 -39.46 52.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.867 -0.606 . . . . 71.44 112.293 -174.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.541 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 9.2 pt-20 -66.91 -38.65 86.62 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.825 0.345 . . . . 70.33 110.677 176.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . 0.424 ' N ' ' HG3' ' A' ' 148' ' ' GLU . 84.3 t80 -53.69 -48.02 69.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.286 -0.416 . . . . 64.11 111.716 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -82.41 -5.47 58.67 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.791 0.329 . . . . 73.33 111.634 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 59.31 26.41 15.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.375 0.67 . . . . 73.41 112.373 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.472 HG23 HG23 ' A' ' 43' ' ' THR . 96.7 t . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 121.023 0.44 . . . . 73.02 112.053 -176.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 CA--C 1.54 0.59 0 CA-C-O 120.874 0.369 . . . . 74.34 110.985 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -54.28 -43.88 71.43 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.14 0.495 . . . . 65.34 111.245 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 137' ' ' LEU . 65.2 tp -59.75 -34.91 73.58 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.839 -0.618 . . . . 73.02 111.437 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -66.65 -46.03 77.06 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.37 -0.377 . . . . 65.34 110.331 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -60.75 -43.64 97.7 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.972 0.415 . . . . 75.15 111.22 177.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -56.17 -53.71 53.91 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.343 0.592 . . . . 71.34 111.131 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.3 m -64.98 -43.78 91.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.659 -0.7 . . . . 55.44 111.495 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.78 -44.69 93.78 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.555 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.35 -51.35 69.77 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.263 0.554 . . . . 74.03 111.193 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.433 HG23 ' HB2' ' A' ' 41' ' ' LEU . 68.1 mt -59.85 -54.06 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.93 -0.577 . . . . 74.24 111.6 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.469 HD12 HG23 ' A' ' 125' ' ' ILE . 81.1 mt -61.99 -42.26 94.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 116.132 -0.485 . . . . 72.42 111.822 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.8 t -55.07 -53.88 50.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.89 0.376 . . . . 71.13 111.836 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.69 -39.15 93.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.552 -0.295 . . . . 64.42 111.511 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.46 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 57.0 t80 -59.85 -49.06 79.19 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.09 0.471 . . . . 71.11 111.489 178.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.0 mp -62.71 -38.13 89.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.765 0.317 . . . . 73.32 111.211 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -65.73 -43.31 89.41 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.011 0.375 . . . . 62.45 112.011 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 3.2 pt-20 -69.49 -39.65 77.51 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.109 -0.369 . . . . 74.3 111.571 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.501 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.6 mm-40 -71.43 -28.08 63.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.788 0.328 . . . . 74.02 111.397 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.57 -41.87 44.83 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 111.872 0.323 . . . . 62.2 111.872 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.3 p -88.27 -29.97 20.0 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.032 0.444 . . . . 64.44 112.184 -178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.947 0 C-N-CA 121.427 -0.416 . . . . 42.31 112.398 -174.558 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 CA-C-O 120.847 0.137 . . . . 37.79 112.797 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.33 68.44 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.152 0.427 . . . . 75.22 112.152 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.584 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . 59.8 m -59.53 -52.04 67.26 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.276 0.472 . . . . 75.35 112.276 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.9 p -61.05 -45.48 94.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.296 -0.411 . . . . 75.05 111.461 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -46.27 81.7 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 111.864 0.32 . . . . 75.02 111.864 179.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.615 ' HG3' HG21 ' A' ' 147' ' ' VAL . 24.2 pttm -67.17 -28.8 68.41 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.088 -0.382 . . . . 73.15 111.62 -178.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.32 -51.92 64.01 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.925 0.393 . . . . 74.42 110.498 173.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.433 ' HB2' HG23 ' A' ' 12' ' ' ILE . 65.5 tp -59.01 -44.85 91.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.31 0.576 . . . . 72.51 111.208 175.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.37 -41.2 88.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.781 -0.645 . . . . 74.25 111.161 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.1 m -72.1 -38.35 69.35 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.315 -0.402 . . . . 54.32 111.02 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.0 mt -53.64 -47.05 70.68 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 111.944 0.35 . . . . 72.21 111.944 177.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -74.14 -29.78 61.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.774 0.321 . . . . 74.31 111.42 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -63.45 -45.1 92.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.796 0.331 . . . . 72.31 111.396 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.84 -30.4 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.028 0.442 . . . . 73.43 111.468 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.39 -44.39 97.65 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.921 -0.582 . . . . 61.04 112.953 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.644 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 23.1 t70 -50.84 -57.37 8.62 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.837 0.351 . . . . 64.21 110.955 176.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.07 -45.13 92.75 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.399 -0.429 . . . . 45.44 113.548 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 85.1 t -62.92 -42.62 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.883 0.373 . . . . 74.12 111.508 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 27.8 mt-30 -66.74 -27.5 67.66 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.024 0.379 . . . . 75.54 112.024 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 21.6 mmt180 -64.07 -42.84 96.84 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.389 . . . . 73.51 111.193 175.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -84.05 -49.82 8.55 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.117 0.484 . . . . 72.33 112.272 -176.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -75.06 -20.99 59.29 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.317 0.858 . . . . 72.22 113.317 -172.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 52' ' ' GLN . 42.7 tt0 -50.49 -52.51 37.66 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.102 0.408 . . . . 74.41 112.102 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -55.69 -36.96 67.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.962 0.41 . . . . 73.22 111.824 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.32 62.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.916 0.389 . . . . 74.21 111.565 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -66.17 -37.94 86.84 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.545 -0.298 . . . . 74.22 111.507 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.608 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 79.4 mm-40 -48.86 -49.49 39.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 74.52 111.175 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -32.28 52.93 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.242 -0.436 . . . . 53.11 113.689 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 46.2 mtm -89.37 -30.22 18.54 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.241 0.543 . . . . 73.22 110.356 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.8 tp -63.04 -30.78 71.87 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 65.13 111.021 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 61.6 mtp180 -68.24 -16.55 64.01 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.934 -0.576 . . . . 72.14 112.222 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.37 5.85 23.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.001 0.429 . . . . 72.04 111.332 176.104 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 98.5 mt -103.85 -73.72 0.66 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.292 -0.413 . . . . 75.23 111.226 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 38.26 87.06 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.125 0.787 . . . . 74.2 113.125 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.52 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -65.92 113.5 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.401 -0.818 . . . . 75.45 112.065 -176.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.475 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -99.91 -6.03 27.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.375 -0.375 . . . . 53.43 111.641 177.581 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.539 HD22 ' HB3' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -173.36 174.62 3.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 120.932 0.396 . . . . 72.35 111.644 172.009 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -50.84 -30.48 14.52 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.493 0.553 . . . . 73.42 112.493 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.539 ' HB3' HD22 ' A' ' 70' ' ' ASN . 29.8 t70 -52.99 -41.75 64.9 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.122 0.487 . . . . 71.34 111.444 176.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.52 ' HB2' HG21 ' A' ' 68' ' ' ILE . 17.4 m-20 -73.18 -28.42 62.2 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.301 -0.409 . . . . 65.01 111.122 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -62.19 -40.92 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.299 0.571 . . . . 74.23 110.386 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.99 -30.72 70.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.042 -0.526 . . . . 74.34 110.851 174.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.5 t -66.06 -37.63 86.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.181 0.515 . . . . 73.32 110.529 171.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.4 mt -62.13 -38.11 87.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.225 -0.443 . . . . 70.53 110.873 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.8 t -52.74 -41.02 63.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.983 0.42 . . . . 72.31 111.198 177.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -55.5 -47.24 76.5 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.752 175.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.61 -41.79 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.969 0.414 . . . . 54.41 111.007 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.507 ' SD ' HD11 ' A' ' 98' ' ' LEU . 22.8 mmt -56.18 -41.99 76.39 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.046 -0.525 . . . . 74.55 111.206 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.67 -37.3 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.16 -0.473 . . . . 74.33 110.957 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -65.11 -28.83 69.71 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 122.339 -0.225 . . . . 70.43 111.388 177.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.99 -39.62 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 71.32 110.994 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.525 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 26.9 m-85 . . . . . 0 CA--C 1.54 0.579 0 CA-C-N 116.302 -0.408 . . . . 73.11 112.034 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 94.1 m95 . . . . . 0 N--CA 1.471 0.615 0 N-CA-C 112.109 0.411 . . . . 65.35 112.109 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.94 -26.83 55.88 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 121.416 -0.421 . . . . 53.11 112.998 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -62.67 -42.17 99.48 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.054 0.454 . . . . 53.03 110.369 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -63.27 -45.26 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.896 -0.593 . . . . 72.44 110.561 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.44 -48.41 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.982 -0.553 . . . . 72.34 110.948 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.4 m -57.26 -45.66 83.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.563 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.525 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 23.8 tp -57.77 -54.94 41.2 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.343 0.592 . . . . 73.04 111.797 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.425 HG23 ' CD2' ' A' ' 16' ' ' TYR . 51.7 mt -71.62 -37.53 63.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.864 -0.607 . . . . 71.41 112.08 -174.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 92.3 p -66.94 -44.08 81.53 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.631 0.253 . . . . 42.35 111.263 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.48 -40.19 93.64 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.799 0.333 . . . . 70.32 110.717 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.14 -47.61 86.22 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.895 -0.669 . . . . 75.05 112.365 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.01 79.6 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.098 0.475 . . . . 65.23 111.5 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 80.2 t80 -62.01 -45.73 92.29 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.059 -0.519 . . . . 74.52 111.325 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 56.2 t -69.93 -38.39 75.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 120.836 0.351 . . . . 75.54 110.787 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.76 69.13 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.292 0.479 . . . . 74.03 112.292 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 18.1 ptpt -62.83 -36.55 83.57 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.851 0.357 . . . . 73.34 111.227 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.419 ' O ' HG12 ' A' ' 112' ' ' ILE . 71.7 t60 -65.3 -33.7 76.59 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.909 0.385 . . . . 65.22 110.33 176.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.493 HD23 ' HB ' ' A' ' 68' ' ' ILE . 89.0 mt -67.41 -50.56 58.96 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.093 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -57.04 -40.57 77.02 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.166 0.508 . . . . 63.43 110.477 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.8 m -55.97 -48.91 74.95 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.604 -0.725 . . . . 64.51 111.699 175.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 108' ' ' HIS . 37.1 pt -88.7 22.2 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 N-CA-C 112.142 0.423 . . . . 62.21 112.142 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 68.32 12.11 8.61 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.918 0.71 . . . . 74.4 112.918 174.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -94.76 38.08 1.12 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.289 0.477 . . . . 71.31 112.289 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.87 -32.27 63.53 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.924 -0.485 . . . . 75.03 110.87 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.7 m -56.9 -29.1 62.71 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.216 -0.447 . . . . 74.33 111.873 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.441 ' HB2' HD12 ' A' ' 109' ' ' LEU . 44.5 m -76.99 -27.07 54.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.485 -0.325 . . . . 71.11 111.706 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.9 mt -59.54 -38.47 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.95 0.352 . . . . 73.02 111.95 -179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.7 -57.17 28.4 Favored Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 112.058 0.392 . . . . 72.13 112.058 -176.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.74 -26.9 60.22 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 121.669 1.579 . . . . 73.02 112.367 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.81 -48.42 76.92 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.706 0.288 . . . . 75.22 110.235 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.39 -40.69 71.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.223 0.535 . . . . 70.42 111.001 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.69 -35.84 79.57 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.928 -0.578 . . . . 64.41 111.357 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.6 m -63.68 -45.41 90.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.731 0.301 . . . . 62.0 111.314 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 13' ' ' ILE . 48.5 mm -54.84 -50.64 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.352 0.596 . . . . 73.12 110.636 175.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 26.7 m -67.93 -33.63 75.06 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.545 -0.752 . . . . 72.45 111.52 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' A' ' 131' ' ' ARG . 15.2 t70 -64.02 -52.73 58.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.375 -0.375 . . . . 51.3 110.681 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 98.5 t -62.49 -41.73 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.149 0.5 . . . . 70.23 110.821 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.532 ' HG ' HD13 ' A' ' 137' ' ' LEU . 48.9 tp -54.32 -52.8 60.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.848 -0.614 . . . . 75.23 111.235 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.46 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 83.2 t -76.02 -27.33 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.157 -0.474 . . . . 73.32 111.9 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 127' ' ' ASP . 0.7 OUTLIER -54.85 -38.12 67.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.22 0.452 . . . . 75.05 112.22 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -130.46 -37.41 1.4 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.154 0.798 . . . . 64.34 113.154 -175.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.405 ' HA ' ' HD1' ' A' ' 136' ' ' TRP . 0.2 OUTLIER -92.5 6.16 48.15 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.971 0.73 . . . . 40.53 112.971 -177.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 12.7 ttp180 -49.83 -64.44 0.81 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.719 0.637 . . . . 74.31 112.719 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.09 -34.06 69.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 75.42 111.924 -178.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . 0.405 ' HD1' ' HA ' ' A' ' 133' ' ' LYS . 50.3 m95 -65.79 -36.52 83.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.303 -0.248 . . . . 74.11 111.222 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.549 ' HB2' HD23 ' A' ' 5' ' ' LEU . 78.5 mt -57.7 -49.01 77.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.811 0.338 . . . . 72.22 111.555 175.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.71 -38.02 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 N-CA-C 112.3 0.482 . . . . 73.51 112.3 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -69.66 -50.31 45.28 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.09 0.404 . . . . 73.45 112.09 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -85.41 1.8 47.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.69 0.281 . . . . 72.14 111.342 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 141' ' ' ARG . 23.2 mtp85 51.59 52.75 14.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.078 -0.51 . . . . 75.31 110.919 -175.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -41.89 -58.04 3.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 114.994 0.758 . . . . 50.22 114.994 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -64.25 -20.25 65.92 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 117.512 0.656 . . . . 75.24 112.629 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -86.52 -57.8 2.86 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.942 0.401 . . . . 74.2 111.511 172.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.3 -34.73 89.26 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.363 -0.38 . . . . 63.24 114.007 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -58.12 -37.62 74.93 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.091 0.472 . . . . 65.54 111.708 177.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.615 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.7 t -72.36 -47.81 50.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.928 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -68.51 -28.09 66.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.02 0.438 . . . . 73.4 111.166 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -55.38 -50.84 68.67 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.022 -0.536 . . . . 64.41 110.866 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.58 -25.97 24.7 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.124 -0.489 . . . . 70.2 111.922 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 77.8 t60 71.31 106.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.83 0.852 . . . . 61.21 112.242 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 51.7 t . . . . . 0 CA--C 1.543 0.694 0 CA-C-N 115.977 -0.556 . . . . 73.44 110.925 177.809 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.0 t70 . . . . . 0 CA--C 1.545 0.788 0 CA-C-O 121.15 0.5 . . . . 74.3 111.553 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -58.97 -43.28 91.34 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.139 0.495 . . . . 74.5 111.481 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 137' ' ' LEU . 65.9 tp -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.98 -0.555 . . . . 74.21 111.084 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -62.01 -43.34 99.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.168 -0.469 . . . . 75.45 110.952 176.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -69.08 -39.43 79.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.472 0.545 . . . . 64.03 112.472 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -60.84 -49.54 77.08 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.12 0.486 . . . . 71.32 110.742 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.8 m -61.89 -47.31 85.56 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.079 -0.51 . . . . 75.32 111.117 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.47 -37.8 79.14 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.395 -0.366 . . . . 63.32 111.225 177.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.72 -53.68 55.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.332 0.587 . . . . 61.13 110.763 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -63.77 -49.77 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.662 -0.699 . . . . 75.23 111.754 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.441 ' O ' HD11 ' A' ' 17' ' ' LEU . 75.3 mt -63.72 -52.12 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 112.146 0.425 . . . . 71.24 112.146 -177.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.6 t -57.17 -48.37 78.89 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-O 120.964 0.411 . . . . 72.14 111.843 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.3 mtp180 -63.4 -40.3 96.84 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.308 -0.405 . . . . 74.14 111.629 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -60.29 -53.33 58.9 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.869 0.366 . . . . 74.32 111.089 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD11 ' O ' ' A' ' 13' ' ' ILE . 9.7 mp -54.92 -39.95 69.34 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.743 0.306 . . . . 65.04 111.293 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -57.22 10.78 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.546 -0.297 . . . . 65.42 111.662 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -61.48 -32.38 72.38 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.0 0.428 . . . . 72.22 111.285 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.46 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 25.4 mm-40 -65.85 -33.98 77.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.176 -0.466 . . . . 72.02 111.852 175.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.98 -41.1 71.45 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.912 0.386 . . . . 71.33 111.433 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.9 p -86.96 -20.75 26.85 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.004 0.43 . . . . 54.35 111.84 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 C-N-CA 121.294 -0.479 . . . . 75.01 112.591 -177.345 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.235 0 N-CA-C 114.633 0.613 . . . . 72.14 114.633 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.79 73.35 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.931 0.715 . . . . 43.22 112.931 -173.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.0 m -54.29 -51.23 65.27 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.129 0.49 . . . . 73.2 111.581 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.6 -35.5 80.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.076 -0.511 . . . . 73.31 111.981 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 61.3 ttt180 -66.04 -55.79 14.84 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.83 0.348 . . . . 75.43 111.066 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HE2' HG12 ' A' ' 147' ' ' VAL . 59.0 mtpt -55.95 -42.29 75.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.085 -0.507 . . . . 71.13 111.352 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.63 -45.57 91.6 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.319 -0.401 . . . . 61.34 111.287 174.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.07 -54.85 35.6 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.892 0.377 . . . . 63.34 111.977 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -66.87 -30.79 71.04 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.919 0.34 . . . . 73.23 111.919 -178.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 47' ' ' VAL . 95.6 m -69.72 -40.91 75.97 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.093 -0.38 . . . . 64.13 110.748 174.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.2 mt -53.99 -37.29 63.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.217 0.532 . . . . 74.4 110.595 171.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -68.18 -52.75 30.95 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.146 -0.479 . . . . 72.1 111.712 175.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.53 ' NE ' ' HA ' ' A' ' 43' ' ' THR . 3.2 ptp180 -66.24 -21.65 66.3 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.634 0.605 . . . . 61.03 112.634 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 43' ' ' THR . 23.3 m -110.09 -33.79 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 122.057 -0.402 . . . . 72.21 111.885 176.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.43 -32.57 71.77 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 121.5 -0.381 . . . . 61.45 113.947 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 28.3 t70 -61.9 -52.15 65.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 117.401 0.601 . . . . 74.02 110.757 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.41 -41.53 95.27 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.47 -0.395 . . . . 65.33 112.977 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 47' ' ' VAL . 69.8 t -59.89 -49.65 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 120.8 0.333 . . . . 74.23 111.084 175.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.517 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 44.5 mt-30 -57.16 -35.98 70.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.585 -0.28 . . . . 52.03 111.508 177.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.4 mmm180 -58.01 -59.76 4.78 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.795 0.331 . . . . 75.33 111.872 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -74.93 -19.29 60.19 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.095 0.406 . . . . 73.33 112.095 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.457 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 37.8 m-70 -90.99 -22.81 20.62 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.529 0.566 . . . . 71.53 112.529 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.486 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 30.0 tt0 -54.56 -51.75 64.24 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.787 0.327 . . . . 64.52 111.818 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -53.37 -29.88 36.76 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.096 0.474 . . . . 73.44 111.771 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.48 -53.86 5.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.073 0.463 . . . . 73.1 111.556 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 15.1 m-85 -58.94 -30.01 67.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.498 0.555 . . . . 74.34 112.498 -177.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -51.16 -40.98 59.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 120.956 0.408 . . . . 75.25 111.404 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.455 ' HA2' ' CZ ' ' A' ' 64' ' ' ARG . . . -61.96 -28.41 70.31 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 121.203 -0.523 . . . . 75.14 113.158 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 81.1 mtp -89.51 -33.23 16.84 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.378 0.608 . . . . 71.33 110.335 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.423 HD21 ' CE2' ' A' ' 104' ' ' PHE . 13.0 tp -63.46 -41.37 98.61 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.744 -0.662 . . . . 62.54 111.449 -176.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.455 ' CZ ' ' HA2' ' A' ' 61' ' ' GLY . 13.3 ptt180 -67.84 -26.0 65.83 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.267 -0.424 . . . . 74.53 111.196 176.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.14 -32.66 56.5 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.069 0.462 . . . . 73.42 111.256 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.75 -73.13 0.41 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.075 -0.511 . . . . 72.3 111.531 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.1 t70 45.35 83.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.438 0.637 . . . . 64.5 111.735 -175.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.467 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.0 mp -64.95 114.62 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 115.9 -0.591 . . . . 64.15 112.17 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -103.89 -8.06 19.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 111.872 0.323 . . . . 61.13 111.872 175.389 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.465 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.6 170.39 14.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.795 0.331 . . . . 60.52 111.738 175.12 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 42.5 tt0 -57.22 -28.55 62.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.315 0.487 . . . . 72.21 112.315 -177.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.98 -39.8 75.32 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 122.183 -0.323 . . . . 70.25 111.768 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -60.97 -43.09 99.26 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.499 0.666 . . . . 74.42 109.742 175.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.479 HG11 ' HA ' ' A' ' 121' ' ' LEU . 69.4 t -58.87 -38.29 72.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.301 -0.863 . . . . 74.34 111.561 175.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -64.7 -40.77 95.94 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.992 0.425 . . . . 71.15 110.729 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 t -64.61 -33.82 76.81 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.136 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.49 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.7 mt -55.82 -33.34 64.37 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.499 -0.319 . . . . 73.51 111.712 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.3 t -54.7 -39.47 68.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.864 0.364 . . . . 73.24 111.123 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.417 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 23.9 mmt180 -58.86 -47.58 84.39 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.281 -0.418 . . . . 65.23 111.375 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.34 -40.71 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.066 0.46 . . . . 75.23 111.112 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.49 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -57.82 -40.27 79.59 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.973 -0.558 . . . . 75.35 111.565 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 75.9 mt -57.78 -37.1 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 121.081 0.467 . . . . 55.42 111.085 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.417 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 71.4 m-70 -72.29 -27.51 62.51 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.414 -0.357 . . . . 74.34 111.631 177.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 84.9 t -57.45 -38.36 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 120.907 0.384 . . . . 60.22 111.26 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.439 ' CE2' HD23 ' A' ' 98' ' ' LEU . 39.6 m-85 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 112.547 0.573 . . . . 74.42 112.547 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.3 m95 . . . . . 0 CA--C 1.552 1.046 0 N-CA-C 112.92 0.711 . . . . 73.14 112.92 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.63 55.65 Favored Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.998 -0.439 . . . . 61.32 113.072 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.745 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.1 mmp_? -62.73 -34.59 77.49 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.535 -0.391 . . . . 60.13 111.275 174.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.3 mm -61.93 -45.94 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.207 0.527 . . . . 51.15 109.876 174.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.0 t -57.71 -42.96 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.746 -0.661 . . . . 45.13 110.967 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.4 m -57.7 -48.2 80.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.382 -0.372 . . . . 74.22 111.137 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 125' ' ' ILE . 37.3 tp -60.02 -54.39 46.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.152 0.501 . . . . 71.32 111.847 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.6 mt -69.62 -34.19 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 CA-C-N 116.284 -0.416 . . . . 63.5 111.921 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.517 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 97.3 p -63.83 -47.37 81.04 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.397 -0.189 . . . . 75.35 111.437 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.42 ' O ' HG21 ' A' ' 105' ' ' VAL . 24.5 t80 -59.7 -41.14 90.1 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.797 0.332 . . . . 74.42 110.833 176.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.64 -45.12 95.14 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.872 -0.68 . . . . 73.23 112.452 175.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.46 ' HB1' ' HG3' ' A' ' 20' ' ' GLN . . . -65.41 -34.6 78.67 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.178 0.514 . . . . 74.04 111.465 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.486 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 58.5 t80 -63.13 -48.35 78.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.895 -0.593 . . . . 74.44 111.321 175.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.42 HG21 ' O ' ' A' ' 101' ' ' PHE . 52.7 t -66.76 -37.36 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.622 -0.263 . . . . 75.54 110.824 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.38 -44.01 68.29 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.992 0.425 . . . . 64.42 111.428 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -55.12 -47.4 75.08 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.157 0.503 . . . . 62.11 110.956 173.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.449 ' O ' HG12 ' A' ' 112' ' ' ILE . 64.8 t60 -65.45 -34.02 77.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.181 -0.463 . . . . 74.11 111.586 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 86.7 mt -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.52 0.2 . . . . 74.21 111.084 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -59.27 -41.75 89.59 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.033 0.444 . . . . 62.41 110.479 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 61.1 m -54.05 -45.52 71.69 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.92 -0.582 . . . . 73.23 111.83 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -93.63 17.46 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 112.097 0.406 . . . . 73.11 112.097 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 71.48 6.62 5.79 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.367 0.877 . . . . 72.34 113.367 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -81.7 45.42 0.89 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.886 0.374 . . . . 74.22 111.389 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -55.54 -43.02 75.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.994 0.518 . . . . 74.42 111.573 -176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.7 p -62.38 -34.56 76.94 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.418 -0.355 . . . . 72.32 111.938 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.2 m -59.43 -26.0 64.81 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.446 0.536 . . . . 75.54 112.446 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.2 mt -53.87 -39.57 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 112.437 0.532 . . . . 74.15 112.437 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.1 -56.77 10.37 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.752 0.649 . . . . 73.12 112.752 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.3 -28.52 72.33 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 121.714 1.609 . . . . 73.54 112.289 176.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.479 ' HA ' HG11 ' A' ' 74' ' ' VAL . 6.4 tt -66.3 -46.58 76.47 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.958 0.409 . . . . 75.25 110.071 174.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.252 -0.431 . . . . 62.41 111.326 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.17 -47.06 81.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.301 -0.409 . . . . 74.53 111.079 175.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.5 m -55.81 -44.36 77.79 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 120.873 0.368 . . . . 74.52 111.23 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.506 HG22 ' HG ' ' A' ' 98' ' ' LEU . 48.9 mm -59.57 -53.5 47.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.172 0.511 . . . . 53.41 111.136 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.8 m -63.0 -36.09 82.41 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.892 -0.594 . . . . 75.55 111.584 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 28.5 t70 -61.08 -52.32 65.4 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.517 -0.31 . . . . 75.34 111.389 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' A' ' 81' ' ' MET . 61.5 t -64.43 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.187 0.518 . . . . 73.51 110.972 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.533 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.5 tp -55.99 -52.85 62.71 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.765 -0.652 . . . . 74.41 111.067 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.496 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 58.7 t -76.09 -24.26 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 115.944 -0.571 . . . . 75.35 111.512 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.9 tpt180 -57.36 -45.55 84.26 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.246 0.461 . . . . 73.44 112.246 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.422 ' C ' ' HD2' ' A' ' 133' ' ' LYS . 2.4 t -114.86 -30.75 6.33 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.906 1.076 . . . . 65.43 113.906 -172.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.422 ' HD2' ' C ' ' A' ' 132' ' ' THR . 13.2 mptt -116.88 29.78 7.72 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.086 0.773 . . . . 72.2 113.086 -176.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 58.2 ttp180 -60.92 -54.6 43.09 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 120.919 0.39 . . . . 75.43 111.877 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -59.68 -36.74 77.08 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.226 -0.443 . . . . 54.11 111.542 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -69.71 -36.82 76.24 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.752 0.279 . . . . 74.24 111.752 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.533 HD11 ' HG ' ' A' ' 129' ' ' LEU . 38.2 mt -57.47 -44.97 85.3 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 111.721 0.267 . . . . 70.12 111.721 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.0 p -78.25 -43.23 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 112.364 0.505 . . . . 63.34 112.364 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -68.59 -36.74 79.12 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.834 0.679 . . . . 74.12 112.834 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -101.13 3.23 40.99 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.178 -0.327 . . . . 74.51 111.531 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 49.65 63.97 1.95 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.043 0.449 . . . . 74.55 110.574 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.09 -47.01 6.46 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 115.114 0.806 . . . . 75.2 115.114 -171.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -75.09 -20.59 59.41 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.676 0.621 . . . . 71.14 112.676 -175.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -84.44 -51.44 6.93 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.054 0.454 . . . . 75.43 110.466 170.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.562 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.91 -32.45 66.35 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.902 -0.59 . . . . 71.43 113.012 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -58.22 -39.91 80.31 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.148 0.499 . . . . 73.33 110.983 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.483 HG12 ' HE2' ' A' ' 39' ' ' LYS . 60.4 t -73.16 -40.46 57.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 116.12 -0.491 . . . . 60.01 111.774 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.562 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 13.7 pt-20 -73.39 -33.85 65.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 111.897 0.332 . . . . 72.24 111.897 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.53 -45.72 92.81 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 75.33 111.603 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -82.3 -9.94 59.29 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.821 0.343 . . . . 73.34 111.311 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 54.78 86.71 0.05 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.687 0.756 . . . . 73.45 111.774 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 74.8 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.24 -0.891 . . . . 74.22 111.819 -174.533 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 . . . . . 0 C--O 1.236 0.371 0 N-CA-C 110.294 -0.262 . . . . 75.01 110.294 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 -38.35 53.04 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.465 0.65 . . . . 65.55 111.055 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 137' ' ' LEU . 63.3 tp -68.82 -35.79 77.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.404 -0.816 . . . . 74.32 112.13 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -69.8 -43.85 71.24 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.981 0.419 . . . . 73.24 110.175 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -59.62 -51.69 68.75 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.048 -0.524 . . . . 61.0 111.418 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -61.57 -52.2 65.41 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.73 0.3 . . . . 61.21 111.75 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.4 m -56.33 -45.48 80.32 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.684 0.278 . . . . 75.22 111.098 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.66 -41.51 95.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.701 0.286 . . . . 75.52 111.279 176.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -60.58 -48.49 81.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.039 0.447 . . . . 71.52 110.748 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.77 -54.12 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 121.109 0.48 . . . . 74.34 111.616 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.453 ' O ' HD11 ' A' ' 17' ' ' LEU . 88.8 mt -61.21 -52.02 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.034 -0.53 . . . . 71.24 111.68 -178.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.8 t -53.58 -47.53 70.03 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.824 0.345 . . . . 71.43 111.197 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 11.1 mtp180 -56.2 -55.62 30.9 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.379 -0.373 . . . . 51.41 111.568 176.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -54.83 -43.78 73.32 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.674 0.274 . . . . 75.54 111.473 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.516 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.8 mp -59.95 -43.54 94.96 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.756 0.313 . . . . 73.31 111.204 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.65 -50.41 67.2 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.798 0.333 . . . . 72.11 111.619 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 25.9 mt-10 -60.44 -38.63 84.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.056 0.455 . . . . 62.21 111.388 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.579 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 29.0 mm-40 -69.83 -46.1 66.38 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.312 -0.403 . . . . 73.32 111.889 176.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.7 81.22 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.1 0.407 . . . . 71.55 112.1 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.7 p -87.45 -28.22 22.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.707 0.289 . . . . 73.41 111.77 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 C-N-CA 121.082 -0.58 . . . . 53.32 112.682 -178.658 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.771 0 N-CA-C 113.718 0.247 . . . . 72.2 113.718 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -49.21 71.15 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 111.842 0.312 . . . . 71.23 111.842 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.7 m -54.63 -46.81 73.98 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.745 0.307 . . . . 72.34 111.806 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.7 m -65.02 -35.63 81.8 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.633 0.254 . . . . 63.42 111.579 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.446 ' NH1' ' HB3' ' A' ' 42' ' ' GLU . 18.1 tpt85 -64.81 -50.47 66.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.818 0.342 . . . . 61.15 110.663 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -59.69 -43.63 93.98 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.809 -0.632 . . . . 72.42 111.35 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.14 81.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.97 0.414 . . . . 75.13 111.215 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.415 ' HG ' HH21 ' A' ' 45' ' ' ARG . 49.0 tp -61.49 -36.76 81.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.277 -0.419 . . . . 63.02 111.852 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.446 ' HB3' ' NH1' ' A' ' 38' ' ' ARG . 15.8 pt-20 -78.99 -37.8 38.35 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.134 -0.354 . . . . 75.45 111.137 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.496 HG21 HG23 ' A' ' 152' ' ' VAL . 95.4 m -63.12 -35.23 79.58 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.893 0.378 . . . . 74.3 110.808 175.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -56.81 -32.76 66.04 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.983 0.421 . . . . 63.5 111.161 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.44 HH22 ' CD ' ' A' ' 19' ' ' GLU . 32.2 mtt-85 -79.07 -43.72 23.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.078 0.466 . . . . 75.23 110.415 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -44.8 59.84 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.588 -0.733 . . . . 75.51 112.324 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.424 ' O ' HG23 ' A' ' 51' ' ' VAL . 34.0 m -106.81 -34.49 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 112.267 0.469 . . . . 71.02 112.267 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.78 -39.64 97.73 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.28 -0.486 . . . . 61.51 113.473 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.35 -56.33 23.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.936 0.398 . . . . 74.32 110.974 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.38 -48.17 77.59 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-N 116.034 -0.53 . . . . 73.42 112.797 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.4 t -57.45 -50.86 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 O-C-N 122.851 -0.205 . . . . 75.13 111.216 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -53.84 -46.91 71.34 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.689 0.255 . . . . 72.51 111.689 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -60.86 -45.69 93.55 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.857 0.688 . . . . 71.02 112.857 -176.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -84.76 -21.2 30.08 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.692 -0.63 . . . . 54.11 112.052 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -90.4 -18.29 25.71 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.322 0.489 . . . . 74.53 112.322 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 40.6 tt0 -49.07 -46.04 43.91 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.558 0.577 . . . . 74.34 112.558 -174.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.2 t -56.17 -35.28 67.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.907 0.384 . . . . 64.4 111.965 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.57 -44.01 21.9 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.811 0.338 . . . . 72.24 111.737 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -59.9 -47.33 86.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.605 -0.27 . . . . 74.52 111.35 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.475 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 75.4 mm-40 -53.15 -38.19 62.49 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.87 0.367 . . . . 61.22 111.028 176.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.24 -41.21 86.31 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.03 -0.605 . . . . 64.44 112.313 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 39.9 mtm -72.78 -34.13 66.73 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.483 -0.422 . . . . 72.51 111.148 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.0 -33.62 73.54 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.647 0.261 . . . . 75.14 110.916 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.475 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 47.3 mtm180 -68.83 -17.3 63.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.156 0.503 . . . . 70.21 111.239 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -95.6 -20.35 19.04 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 72.24 110.917 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.6 mt -99.83 -82.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.06 -0.518 . . . . 51.11 111.865 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.7 t0 48.63 98.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.702 0.763 . . . . 63.21 111.97 -172.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.439 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.6 mp -76.32 123.81 33.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 115.614 -0.721 . . . . 74.0 111.904 -175.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.402 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -113.25 -5.55 13.63 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.22 0.452 . . . . 52.43 112.22 177.148 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.402 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -167.35 174.14 8.28 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.924 0.392 . . . . 71.43 111.625 173.379 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.08 -38.91 58.79 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.434 0.531 . . . . 75.52 112.434 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -51.3 -41.79 60.74 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.241 0.459 . . . . 75.24 112.241 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.439 ' HB2' HG21 ' A' ' 68' ' ' ILE . 20.5 m-20 -63.21 -43.11 99.04 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.889 0.376 . . . . 70.4 110.647 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 117' ' ' SER . 72.6 t -56.38 -43.43 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.92 -0.582 . . . . 73.35 110.993 177.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -73.07 -29.38 62.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.186 -0.461 . . . . 64.44 111.511 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.8 m -68.39 -28.67 67.31 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.933 0.397 . . . . 71.33 110.851 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 86.7 mt -55.67 -28.38 55.18 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.339 -0.391 . . . . 74.21 111.452 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.416 ' O ' HG13 ' A' ' 82' ' ' ILE . 81.3 p -52.13 -35.27 47.85 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 120.798 0.333 . . . . 74.12 111.373 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -61.75 -45.55 93.42 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.99 0.424 . . . . 74.22 110.713 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 82.4 t -64.16 -42.79 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.141 0.496 . . . . 74.03 110.354 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.472 ' SD ' HD11 ' A' ' 98' ' ' LEU . 21.7 mmt -56.17 -38.93 71.59 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.709 -0.678 . . . . 71.13 111.673 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 78' ' ' SER . 85.0 mt -64.37 -41.24 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.098 0.475 . . . . 74.14 110.911 174.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -64.73 -27.93 69.24 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.046 0.388 . . . . 65.42 112.046 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.0 t -55.28 -34.63 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 121.016 0.436 . . . . 62.14 111.911 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 CA--C 1.548 0.881 0 N-CA-C 112.057 0.392 . . . . 74.52 112.057 179.935 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.42 ' HE3' HG13 ' A' ' 95' ' ' ILE . 79.4 m95 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 120.964 0.411 . . . . 73.52 110.701 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.64 -41.36 99.83 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.311 -0.404 . . . . 71.34 112.589 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -51.77 -38.14 54.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.901 0.381 . . . . 75.02 111.636 171.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.42 HG13 ' HE3' ' A' ' 92' ' ' TRP . 36.9 mm -69.6 -43.21 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.987 0.423 . . . . 65.12 110.561 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.69 -53.19 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.199 -0.455 . . . . 74.14 111.029 175.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.9 m -57.79 -45.0 86.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.226 -0.443 . . . . 72.12 111.504 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.494 ' HG ' HG22 ' A' ' 125' ' ' ILE . 26.7 tp -57.33 -54.63 44.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.167 0.508 . . . . 54.24 111.631 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.84 -41.94 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.236 -0.438 . . . . 74.54 111.739 -178.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.9 m -63.02 -41.18 99.48 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.674 0.273 . . . . 53.23 111.391 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 105' ' ' VAL . 29.5 t80 -68.89 -40.15 79.36 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.681 0.277 . . . . 74.14 110.742 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.17 -48.01 83.24 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 120.834 -0.698 . . . . 37.55 112.221 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.516 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.9 -35.13 80.14 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.136 0.494 . . . . 62.2 111.374 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.416 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 44.2 t80 -61.83 -50.89 70.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.905 -0.588 . . . . 73.15 110.919 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 101' ' ' PHE . 59.3 t -62.33 -38.54 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 116.33 -0.395 . . . . 73.41 110.815 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.33 -41.01 71.89 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.871 0.367 . . . . 60.34 111.618 176.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.579 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 95.8 mttt -58.06 -44.87 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.057 0.456 . . . . 71.05 111.046 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.406 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -67.64 -36.46 80.83 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.346 -0.388 . . . . 75.54 111.163 177.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.48 -50.36 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.611 0.243 . . . . 72.53 111.556 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -60.92 -40.83 94.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.047 0.451 . . . . 63.24 110.712 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.1 m -58.81 -39.13 80.26 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.154 -0.475 . . . . 75.14 112.239 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 108' ' ' HIS . 38.5 pt -94.55 17.2 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.654 0.613 . . . . 71.34 112.654 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 71.74 12.59 6.28 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.747 0.647 . . . . 63.04 112.747 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -97.95 31.65 2.62 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.324 . . . . 74.14 111.347 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.413 ' HG3' HD11 ' A' ' 118' ' ' ILE . 38.4 tt0 -56.74 -35.64 68.84 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.196 0.443 . . . . 61.31 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.7 m -56.56 -27.51 57.93 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.026 0.441 . . . . 73.42 111.576 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.51 ' HB3' HG23 ' A' ' 74' ' ' VAL . 53.4 m -71.26 -25.82 62.63 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.405 0.521 . . . . 62.12 112.405 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.413 HD11 ' HG3' ' A' ' 115' ' ' GLU . 72.6 mt -53.59 -46.74 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 113.08 0.77 . . . . 75.12 113.08 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.58 -54.08 32.83 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 112.497 0.555 . . . . 63.3 112.497 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.19 -26.44 69.64 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.575 1.516 . . . . 71.4 112.492 174.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.41 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.4 tt -67.36 -44.65 78.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.717 -0.475 . . . . 74.53 109.717 173.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.42 ' HB3' HD23 ' A' ' 17' ' ' LEU . . . -59.16 -37.79 78.18 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.074 0.464 . . . . 71.43 111.099 174.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.14 -38.64 91.27 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.116 -0.493 . . . . 73.41 110.682 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.0 m -63.05 -44.17 96.58 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 120.815 0.341 . . . . 63.35 111.136 175.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.494 HG22 ' HG ' ' A' ' 98' ' ' LEU . 47.5 mm -56.34 -53.04 44.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.179 0.514 . . . . 71.01 110.656 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -63.7 -35.77 81.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.737 -0.665 . . . . 74.22 111.55 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 27.0 t70 -62.88 -52.06 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.539 -0.3 . . . . 71.35 111.396 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 65.0 t -62.23 -46.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.163 0.506 . . . . 73.35 110.442 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.546 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.7 tp -49.94 -53.07 28.53 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.526 -0.761 . . . . 65.53 111.673 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.497 HG12 ' HD3' ' A' ' 134' ' ' ARG . 71.2 t -76.92 -32.94 20.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.912 -0.586 . . . . 74.41 112.166 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 16.0 tpt180 -55.26 -33.13 62.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.008 0.432 . . . . 60.44 111.738 -176.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -40.73 3.35 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.672 0.619 . . . . 65.42 112.672 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -101.9 18.94 19.32 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.48 0.918 . . . . 73.3 113.48 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.497 ' HD3' HG12 ' A' ' 130' ' ' VAL . 14.8 tpt180 -47.28 -56.37 6.91 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.591 0.589 . . . . 73.11 112.591 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.35 -42.8 58.78 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.824 0.345 . . . . 70.43 111.069 -177.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -56.43 -37.37 70.13 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.503 -0.317 . . . . 75.55 111.824 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.546 HD11 ' HG ' ' A' ' 129' ' ' LEU . 18.4 mt -55.05 -51.17 67.16 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.421 -0.354 . . . . 72.3 111.924 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.1 p -77.78 -43.06 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.631 -0.668 . . . . 74.01 112.071 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -58.72 -40.59 84.18 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.233 0.457 . . . . 73.15 112.233 -177.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -101.66 10.85 39.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.27 0.557 . . . . 72.21 110.7 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.596 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 23.0 mtm180 67.17 7.21 5.28 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.349 -0.841 . . . . 75.02 113.088 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 137' ' ' LEU . . . 32.21 -82.65 0.0 OUTLIER Glycine 0 N--CA 1.468 0.827 0 N-CA-C 115.711 1.045 . . . . 73.14 115.711 173.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.428 ' N ' ' O ' ' A' ' 141' ' ' ARG . 40.2 m95 -70.87 -46.48 62.56 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.341 0.256 . . . . 72.43 111.382 -176.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 23.7 m-20 -61.85 -39.94 93.59 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.056 0.455 . . . . 73.1 110.025 170.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.55 91.14 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 115.85 -0.614 . . . . 63.3 112.503 176.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -67.14 -44.19 80.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.074 0.55 . . . . 65.54 111.111 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 143' ' ' TRP . 94.8 t -62.96 -44.29 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 116.199 -0.455 . . . . 64.43 111.898 178.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.58 -32.07 63.94 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.675 0.274 . . . . 71.33 111.738 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -55.82 -50.42 70.58 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.954 0.407 . . . . 71.12 111.79 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.18 -14.02 45.27 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.225 -0.443 . . . . 72.45 112.098 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 57.61 79.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.198 0.599 . . . . 72.03 111.569 -173.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.496 HG23 HG21 ' A' ' 43' ' ' THR . 93.1 t . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.858 -0.61 . . . . 70.12 110.334 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 112.633 0.605 . . . . 62.03 112.633 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.08 -40.01 60.57 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.532 0.682 . . . . 72.02 110.5 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -58.05 -38.7 76.79 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 115.487 -0.779 . . . . 71.31 111.692 176.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -67.53 -41.18 84.77 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.522 -0.308 . . . . 73.22 110.581 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -53.94 -51.45 63.78 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.769 0.318 . . . . 65.44 111.439 176.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.68 -52.73 59.35 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.056 0.391 . . . . 63.31 112.056 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -57.83 -43.17 85.64 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.283 -0.417 . . . . 73.03 111.389 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.21 -41.78 98.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.55 -0.296 . . . . 73.51 111.673 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -59.25 -51.61 69.22 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.897 0.379 . . . . 64.42 111.412 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.89 -52.51 48.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.201 0.524 . . . . 74.44 111.486 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.18 -42.39 88.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.921 -0.581 . . . . 74.3 111.825 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 t -59.62 -49.59 77.18 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.63 0.252 . . . . 64.45 111.587 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.459 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 67.1 mtt180 -59.23 -48.1 82.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.871 0.367 . . . . 62.5 110.685 177.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.406 ' HH ' ' HA3' ' A' ' 48' ' ' GLY . 57.5 t80 -56.82 -54.96 40.37 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.257 -0.429 . . . . 74.11 112.055 -177.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.34 -40.21 81.55 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.791 0.293 . . . . 74.33 111.791 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -63.47 -57.5 10.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 111.907 0.336 . . . . 74.15 111.907 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.2 mm-40 -66.66 -31.32 71.93 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.937 0.399 . . . . 72.34 111.828 -177.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -76.36 -34.48 58.92 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.632 0.253 . . . . 73.24 111.423 179.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.93 -34.54 71.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.168 0.509 . . . . 43.25 110.982 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.73 ' HA ' ' HZ3' ' A' ' 110' ' ' LYS . 79.3 p -86.95 -22.33 25.68 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.08 -0.509 . . . . 75.43 111.794 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.665 0 C-N-CA 121.319 -0.467 . . . . 55.13 112.712 -178.842 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.888 0 N-CA-C 113.505 0.162 . . . . 55.13 113.505 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.89 -38.35 70.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.464 0.542 . . . . 54.33 112.464 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.464 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 25.1 m -58.98 -48.07 82.87 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.971 0.415 . . . . 73.03 111.82 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.4 t -64.88 -43.14 93.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.972 0.415 . . . . 70.11 111.065 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -60.84 -54.7 41.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.267 -0.424 . . . . 65.24 112.142 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.495 ' HG3' HG22 ' A' ' 147' ' ' VAL . 20.8 ptmt -56.03 -41.85 75.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.559 0.218 . . . . 74.01 111.054 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.05 87.77 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.766 0.317 . . . . 73.14 111.524 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.4 tp -58.85 -54.7 44.18 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.524 0.565 . . . . 64.0 112.524 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.05 -27.75 63.87 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.105 -0.372 . . . . 64.42 111.756 -176.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.474 HG23 HG23 ' A' ' 152' ' ' VAL . 46.8 m -62.75 -45.19 93.86 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 120.827 0.346 . . . . 73.35 110.135 171.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -54.57 -34.65 62.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.29 -0.414 . . . . 73.52 111.719 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -70.73 -52.21 22.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.785 0.326 . . . . 72.41 110.945 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -58.85 -44.27 90.95 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.15 -0.477 . . . . 74.13 112.164 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 43' ' ' THR . 19.5 m -87.98 -33.05 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 120.948 0.404 . . . . 73.0 111.942 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.406 ' HA3' ' HH ' ' A' ' 16' ' ' TYR . . . -68.02 -30.34 74.0 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 114.229 0.451 . . . . 61.12 114.229 -174.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.511 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 29.6 t70 -58.42 -57.61 12.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 117.568 0.684 . . . . 75.21 111.277 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.07 -42.08 98.3 Favored Glycine 0 CA--C 1.526 0.763 0 C-N-CA 121.353 -0.451 . . . . 55.2 113.006 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 77.0 t -57.52 -45.47 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 122.593 -0.357 . . . . 73.15 111.067 176.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -61.27 -43.86 98.19 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.76 -0.2 . . . . 73.13 111.22 175.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.511 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 4.3 mmp_? -57.25 -49.4 76.16 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.826 0.346 . . . . 75.24 111.494 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -66.17 -47.65 73.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.155 0.502 . . . . 64.2 111.637 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -73.05 -20.69 60.93 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.943 -0.571 . . . . 71.14 112.453 -176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -49.1 -54.59 15.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.324 0.491 . . . . 74.21 112.324 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 t -53.24 -36.73 61.39 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.419 0.525 . . . . 75.33 112.419 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.08 14.81 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.014 0.435 . . . . 53.31 111.538 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -60.04 -36.57 77.57 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.342 -0.39 . . . . 73.24 111.882 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.528 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 70.7 mm-40 -47.13 -50.99 19.17 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 120.985 0.421 . . . . 53.24 111.254 176.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.78 -35.47 67.98 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.098 -0.501 . . . . 75.44 113.208 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 45.0 mtm -77.15 -44.59 29.75 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 122.301 -0.529 . . . . 60.24 111.143 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.429 HD13 HG21 ' A' ' 105' ' ' VAL . 9.1 mp -54.88 -27.73 44.96 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.132 -0.355 . . . . 72.11 111.416 176.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.528 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 99.4 mtt180 -65.02 -44.72 88.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.749 0.309 . . . . 73.24 111.562 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.69 -7.07 55.42 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.344 0.498 . . . . 70.34 112.344 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.1 mt -96.35 -71.66 0.67 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.052 0.453 . . . . 74.04 111.209 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t0 47.46 88.85 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.248 -0.887 . . . . 72.32 111.838 -172.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.5 HG21 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -73.22 103.09 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.914 -0.584 . . . . 64.23 111.053 -178.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.429 ' HD3' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.09 -11.3 16.66 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.101 0.408 . . . . 75.03 112.101 -179.294 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.429 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 1.2 p30 -154.42 176.79 11.91 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.024 0.44 . . . . 72.52 111.978 178.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.1 -39.72 79.36 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.163 -0.471 . . . . 74.12 112.119 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -56.1 -39.87 72.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.483 -0.326 . . . . 73.04 111.747 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.5 ' HB2' HG21 ' A' ' 68' ' ' ILE . 50.8 m-20 -62.23 -39.12 91.76 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.938 0.399 . . . . 73.41 110.711 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.423 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 82.2 t -60.87 -46.8 95.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.206 0.526 . . . . 65.35 110.927 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 78' ' ' SER . 99.7 mttt -65.91 -28.78 69.19 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.889 0.376 . . . . 62.54 111.186 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.9 m -67.55 -36.48 81.04 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.791 0.329 . . . . 51.12 110.492 171.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.7 mt -59.44 -39.98 85.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.668 0.27 . . . . 74.43 110.617 173.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 28.9 t -52.46 -37.02 56.07 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.96 0.409 . . . . 44.5 111.225 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -61.37 -47.27 86.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.947 0.403 . . . . 64.15 110.361 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.448 ' O ' HG21 ' A' ' 84' ' ' VAL . 59.7 t -60.89 -42.86 94.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.263 -0.426 . . . . 75.31 110.892 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.533 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -54.54 -44.14 72.57 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.238 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 78' ' ' SER . 74.9 mt -61.79 -36.9 76.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.146 0.498 . . . . 64.12 111.137 176.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -71.65 -27.47 63.1 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.073 0.397 . . . . 64.53 112.073 178.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.448 HG21 ' O ' ' A' ' 80' ' ' VAL . 94.1 t -58.82 -23.84 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 N-CA-C 111.994 0.368 . . . . 73.25 111.994 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.456 ' CE2' HD22 ' A' ' 98' ' ' LEU . 58.0 m-85 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.437 0.532 . . . . 65.25 112.437 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.4 m95 . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.285 0.476 . . . . 74.41 112.285 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.47 -27.81 54.61 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 120.978 -0.63 . . . . 70.24 113.506 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.9 mtp85 -65.8 -25.64 67.33 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.52 -0.4 . . . . 74.44 112.0 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.4 mm -57.03 -40.75 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 121.247 0.546 . . . . 71.43 110.16 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.42 -41.45 88.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 116.031 -0.531 . . . . 64.32 110.886 176.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.6 m -57.86 -44.26 86.48 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.859 0.361 . . . . 64.04 111.233 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.456 HD22 ' CE2' ' A' ' 85' ' ' PHE . 31.5 tp -61.39 -54.94 37.19 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.184 0.516 . . . . 70.11 111.693 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.37 -37.01 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.136 -0.484 . . . . 75.1 112.193 -176.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.6 p -64.05 -41.88 97.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.653 -0.249 . . . . 72.45 111.282 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 105' ' ' VAL . 16.0 t80 -60.17 -43.48 95.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.921 0.391 . . . . 73.45 110.577 175.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.72 -46.42 92.26 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.969 -0.634 . . . . 51.31 112.552 174.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.13 80.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.941 0.401 . . . . 71.33 111.682 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -65.59 -47.98 73.9 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.267 -0.424 . . . . 70.04 111.025 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 101' ' ' PHE . 41.6 t -64.92 -34.24 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.93 0.395 . . . . 74.33 110.546 176.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.09 -39.91 79.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.134 -0.485 . . . . 65.53 111.405 176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.25 -46.2 83.26 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.15 0.5 . . . . 72.24 110.906 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -62.3 -35.8 80.14 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.988 -0.551 . . . . 73.04 110.937 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 117' ' ' SER . 98.4 mt -65.29 -45.0 86.18 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.259 -0.428 . . . . 73.42 111.198 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.73 ' HZ3' ' HA ' ' A' ' 22' ' ' THR . 84.1 tttt -57.53 -43.57 84.46 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.534 0.207 . . . . 62.41 111.081 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.5 m -54.65 -48.42 72.34 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.988 0.423 . . . . 73.24 111.505 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.8 pt -90.02 17.53 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 112.159 0.429 . . . . 64.23 112.159 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 67.69 9.11 6.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.701 1.0 . . . . 74.13 113.701 174.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.52 43.56 1.12 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.83 -0.544 . . . . 61.3 111.76 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.15 -28.98 70.03 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 122.167 -0.333 . . . . 65.32 111.655 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.0 m -56.41 -27.76 57.41 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.764 0.316 . . . . 73.31 111.499 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.52 ' HB2' HD11 ' A' ' 109' ' ' LEU . 43.9 m -74.43 -26.78 60.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.107 0.41 . . . . 65.12 112.107 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.93 -45.43 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 112.994 0.739 . . . . 62.34 112.994 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.84 -51.48 19.89 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.659 0.615 . . . . 73.41 112.659 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.28 -28.69 85.38 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.638 1.559 . . . . 75.14 111.936 172.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.04 -45.02 82.93 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 109.539 -0.541 . . . . 72.15 109.539 173.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.18 82.99 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.057 0.456 . . . . 71.15 110.905 173.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.23 -32.56 74.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.365 -0.38 . . . . 64.51 111.013 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.1 m -65.01 -46.25 82.16 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.946 0.403 . . . . 64.45 110.863 175.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.407 HG22 ' HG ' ' A' ' 98' ' ' LEU . 45.1 mm -56.26 -50.76 69.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.427 0.632 . . . . 74.3 110.642 175.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.2 m -64.24 -41.2 97.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.399 -0.819 . . . . 55.22 111.748 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.1 t70 -60.65 -52.01 66.95 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.542 -0.299 . . . . 65.2 110.692 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.493 HG23 ' HB2' ' A' ' 81' ' ' MET . 93.2 t -58.04 -44.63 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 121.113 0.482 . . . . 73.25 111.252 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.56 ' HG ' HD11 ' A' ' 137' ' ' LEU . 14.0 tp -55.35 -51.98 65.01 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.4 0.619 . . . . 64.14 110.85 178.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.414 HG11 ' HB2' ' A' ' 134' ' ' ARG . 90.3 t -75.5 -26.38 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.728 -0.669 . . . . 54.05 112.032 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.3 tpp180 -61.46 -35.27 77.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.924 0.392 . . . . 73.01 111.969 -176.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.494 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.7 t -121.79 -33.19 3.62 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.801 0.667 . . . . 63.11 112.801 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.494 ' HG2' HG23 ' A' ' 132' ' ' THR . 46.4 mmtm -114.72 20.53 15.17 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.262 0.838 . . . . 73.3 113.262 -172.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.414 ' HB2' HG11 ' A' ' 130' ' ' VAL . 44.1 ttp180 -56.41 -51.67 67.49 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.089 0.471 . . . . 71.43 111.637 177.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.66 -47.33 84.81 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.922 -0.581 . . . . 71.11 111.123 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -61.67 -37.15 83.02 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 111.611 0.226 . . . . 71.51 111.611 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.56 HD11 ' HG ' ' A' ' 129' ' ' LEU . 20.7 mt -58.29 -48.07 81.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.645 -0.252 . . . . 73.34 111.672 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.6 p -78.34 -39.66 24.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 112.161 0.43 . . . . 74.42 112.161 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -67.03 -49.7 64.4 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.413 0.523 . . . . 73.14 112.413 -177.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -94.6 -1.35 53.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.698 0.285 . . . . 75.33 111.482 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 55.63 79.02 0.17 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.406 0.622 . . . . 75.32 111.078 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -54.47 -53.28 39.46 Favored Glycine 0 C--N 1.335 0.478 0 CA-C-N 115.244 -0.889 . . . . 64.31 114.28 -173.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -65.55 -40.03 92.38 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.132 0.466 . . . . 75.24 111.88 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 6.4 m-20 -62.2 -58.55 7.34 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.829 0.347 . . . . 75.12 110.866 175.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -59.02 -31.19 68.04 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 121.329 -0.462 . . . . 45.22 112.831 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -58.88 -55.73 31.34 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.167 0.508 . . . . 74.12 111.119 175.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.495 HG22 ' HG3' ' A' ' 39' ' ' LYS . 93.5 t -63.85 -36.83 77.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 116.147 -0.479 . . . . 64.51 111.568 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 55.1 mt-10 -66.82 -39.14 87.58 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.93 0.395 . . . . 73.34 111.236 176.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -61.32 -48.97 78.9 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.903 0.383 . . . . 73.32 111.788 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.46 -22.53 35.16 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.011 0.374 . . . . 63.44 112.011 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.1 t60 61.08 88.16 0.09 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.524 0.678 . . . . 74.31 111.044 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 43' ' ' THR . 76.8 t . . . . . 0 N--CA 1.467 0.378 0 CA-C-N 115.717 -0.674 . . . . 62.12 110.689 178.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 108.873 -0.788 . . . . 74.52 108.873 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -61.28 -33.69 73.96 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.386 -0.821 . . . . 61.22 111.413 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.48 -35.39 75.78 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.088 0.47 . . . . 60.12 110.497 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -67.27 -36.15 81.0 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.046 -0.525 . . . . 74.23 110.24 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 4.4 mpt_? -61.98 -51.26 68.79 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.639 -0.255 . . . . 71.14 111.544 176.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.41 -48.01 83.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.018 0.437 . . . . 73.45 111.75 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 p -60.67 -52.81 63.57 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.389 -0.369 . . . . 53.24 111.344 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.9 tp -58.78 -35.96 73.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.008 0.433 . . . . 64.11 111.615 176.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 21.3 tt0 -59.27 -52.93 63.53 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.274 0.559 . . . . 75.31 110.619 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -63.85 -53.96 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 115.646 -0.707 . . . . 74.41 111.774 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.426 ' O ' HD11 ' A' ' 17' ' ' LEU . 82.8 mt -59.16 -49.85 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 112.17 0.433 . . . . 74.15 112.17 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.7 t -55.16 -50.26 69.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 120.853 0.359 . . . . 71.23 111.524 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -60.86 -42.78 98.54 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.636 -0.256 . . . . 72.1 111.593 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.402 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 85.1 t80 -58.48 -52.86 63.87 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.896 0.379 . . . . 75.42 111.765 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.426 HD11 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -54.47 -41.2 69.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.879 0.371 . . . . 60.35 111.581 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.432 ' NH2' ' HG3' ' A' ' 119' ' ' GLU . 19.4 mmt85 -65.2 -52.78 52.72 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.352 0.501 . . . . 65.23 112.352 178.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.39 -34.27 76.38 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.846 0.355 . . . . 75.13 111.955 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 33.3 mm-40 -69.64 -32.02 70.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.882 0.372 . . . . 73.11 111.208 176.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.52 -29.65 61.48 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.37 -0.377 . . . . 71.22 111.921 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.507 HG21 ' HE3' ' A' ' 110' ' ' LYS . 51.5 p -87.17 -30.43 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.826 0.346 . . . . 65.14 111.753 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.755 0 C-N-CA 121.26 -0.495 . . . . 72.34 112.399 -176.281 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.041 0 N-CA-C 113.93 0.332 . . . . 74.23 113.93 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.48 -50.83 69.85 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.917 0.71 . . . . 62.41 112.917 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.8 m -57.77 -50.76 72.16 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.169 0.433 . . . . 72.02 112.169 -177.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.8 p -57.78 -48.06 80.77 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.566 -0.288 . . . . 73.43 111.703 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.0 ttt-85 -52.97 -54.66 31.84 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.913 0.387 . . . . 71.44 111.288 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -55.86 -48.64 75.17 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.921 -0.582 . . . . 62.2 111.161 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.35 -41.34 98.84 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.273 -0.421 . . . . 71.22 111.829 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.24 -53.39 49.93 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 111.775 0.287 . . . . 73.34 111.775 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -64.35 -31.34 72.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.771 0.32 . . . . 72.35 111.409 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.483 ' O ' HG22 ' A' ' 47' ' ' VAL . 86.2 m -67.17 -44.15 80.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.778 0.323 . . . . 71.54 110.57 174.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 39.2 mt -54.9 -44.19 73.93 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.495 0.554 . . . . 64.12 112.495 178.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -72.25 -37.54 69.09 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.538 0.57 . . . . 72.23 112.538 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.41 ' NH1' HG11 ' A' ' 152' ' ' VAL . 16.1 ptm180 -73.77 -41.36 62.56 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.965 -0.46 . . . . 73.13 111.814 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 43' ' ' THR . 17.2 m -79.11 -33.51 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.189 0.518 . . . . 73.22 110.734 176.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -59.68 -50.33 68.91 Favored Glycine 0 C--O 1.225 -0.451 0 CA-C-N 115.74 -0.664 . . . . 50.25 112.751 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -53.87 -46.59 71.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.898 0.349 . . . . 73.34 111.51 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.08 -48.41 79.87 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 121.14 -0.552 . . . . 73.22 112.9 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 70.9 t -63.52 -47.08 93.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.909 0.385 . . . . 73.0 111.378 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.5 mt-30 -55.18 -47.41 75.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.197 -0.456 . . . . 74.42 111.595 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -57.81 -42.0 83.35 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.11 0.781 . . . . 73.24 113.11 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -84.87 -27.58 26.59 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.821 -0.549 . . . . 70.32 111.906 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -90.72 -18.21 25.41 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.221 0.823 . . . . 75.15 113.221 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.463 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 31.7 tt0 -49.15 -51.12 34.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.862 0.689 . . . . 71.31 112.862 -170.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.71 -35.51 70.75 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.051 0.453 . . . . 53.12 111.655 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.05 -49.59 49.69 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.267 -0.424 . . . . 73.55 111.615 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.92 -40.8 98.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.697 0.258 . . . . 74.25 111.697 178.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.579 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 74.7 mm-40 -51.34 -44.7 62.09 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.597 0.237 . . . . 72.41 111.131 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.435 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -51.85 -38.72 46.32 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.229 -0.51 . . . . 61.24 112.826 176.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.434 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 84.9 mtp -73.3 -43.21 61.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 54.52 111.121 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -57.46 -29.36 64.14 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.15 0.426 . . . . 75.23 112.15 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.579 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 53.8 mtm180 -64.51 -10.99 29.43 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.621 0.6 . . . . 74.05 112.621 -178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -122.3 -0.74 9.29 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.009 0.433 . . . . 73.4 111.424 173.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.1 mt -97.12 -78.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.385 -0.37 . . . . 75.15 110.889 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 68.11 -47.93 0.53 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.161 1.171 . . . . 74.13 114.161 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.434 ' N ' HD13 ' A' ' 68' ' ' ILE . 2.2 mp 65.58 114.82 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.7 0.8 . . . . 75.03 111.938 -177.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -114.54 -5.41 12.8 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.286 -0.416 . . . . 72.0 111.717 176.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.489 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -170.46 175.84 4.62 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.714 0.292 . . . . 65.53 111.341 172.615 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.526 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 37.8 tt0 -58.21 -24.04 57.82 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.995 0.369 . . . . 72.33 111.995 -178.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.411 ' HB3' HD22 ' A' ' 70' ' ' ASN . 36.9 t70 -56.01 -45.25 79.14 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.782 0.325 . . . . 71.33 111.016 176.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -63.6 -41.28 98.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.113 0.483 . . . . 65.34 110.412 175.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.0 t -56.74 -43.57 79.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 115.997 -0.547 . . . . 73.31 111.323 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 71' ' ' GLU . 65.3 mttm -60.15 -39.66 87.14 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.293 0.568 . . . . 74.1 110.564 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.1 t -66.79 -33.12 74.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.974 -0.557 . . . . 75.54 110.969 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.448 ' O ' ' HG2' ' A' ' 81' ' ' MET . 85.4 mt -61.01 -37.28 81.98 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.72 0.295 . . . . 54.12 110.798 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 82' ' ' ILE . 45.4 t -52.75 -41.22 63.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.998 0.427 . . . . 72.31 111.098 177.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -56.23 -44.58 79.7 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.164 0.507 . . . . 74.32 110.749 177.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.2 t -69.95 -41.08 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.782 -0.644 . . . . 70.14 111.392 178.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.5 mmt -55.54 -38.82 69.79 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.025 0.441 . . . . 71.14 111.605 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 78' ' ' SER . 70.9 mt -58.49 -40.72 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.248 0.547 . . . . 54.13 110.85 173.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.0 -25.8 60.09 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.912 -0.585 . . . . 64.45 112.47 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 94.9 t -54.0 -25.33 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-O 120.981 0.42 . . . . 75.31 111.709 175.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.591 ' HZ ' HD23 ' A' ' 98' ' ' LEU . 79.2 m-85 . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 112.474 0.546 . . . . 74.43 112.474 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.549 ' HE3' HG13 ' A' ' 95' ' ' ILE . 90.9 m95 . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 112.756 0.65 . . . . 75.14 112.756 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.24 -35.47 70.83 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 121.056 -0.592 . . . . 54.43 112.418 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -56.12 -40.49 73.83 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.865 0.466 . . . . 74.21 111.603 173.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.549 HG13 ' HE3' ' A' ' 92' ' ' TRP . 40.1 mm -67.79 -44.95 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 120.937 0.399 . . . . 74.23 110.563 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.6 t -55.06 -46.32 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 116.099 -0.5 . . . . 74.53 111.118 176.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -58.78 -46.92 86.43 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 73.24 111.597 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.591 HD23 ' HZ ' ' A' ' 85' ' ' PHE . 26.2 tp -57.76 -55.02 40.23 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.213 0.53 . . . . 75.34 111.661 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.8 mt -69.19 -35.89 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.972 -0.558 . . . . 74.23 111.912 -174.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.8 p -68.19 -43.13 78.79 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.56 0.219 . . . . 65.14 111.172 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -63.18 -42.35 99.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.775 0.321 . . . . 75.42 111.101 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.91 -48.1 84.51 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.896 -0.668 . . . . 73.34 112.158 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.42 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.41 -32.49 74.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.152 0.501 . . . . 51.14 111.353 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 39.3 t80 -63.81 -47.5 80.63 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.895 -0.593 . . . . 73.22 110.832 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.97 -36.39 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.286 -0.416 . . . . 54.3 110.515 175.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.14 -42.5 69.61 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.279 -0.418 . . . . 73.11 111.759 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -56.68 -49.11 76.06 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.438 0.637 . . . . 73.22 110.706 175.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -61.18 -33.47 73.49 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.492 -0.776 . . . . 71.32 111.07 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.35 -49.57 54.36 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.429 -0.35 . . . . 70.14 111.869 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.507 ' HE3' HG21 ' A' ' 22' ' ' THR . 63.6 tttm -64.35 -33.55 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.723 0.297 . . . . 74.51 111.183 -179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 84.0 m -54.54 -44.02 72.46 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.167 0.508 . . . . 73.24 110.944 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.2 pt -95.43 31.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 116.104 -0.498 . . . . 75.11 111.528 176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 9.3 p30 48.71 22.18 0.5 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.916 1.286 . . . . 64.31 114.224 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -93.61 35.98 1.1 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.122 0.487 . . . . 73.15 110.81 173.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -54.9 -29.17 55.3 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.093 -0.503 . . . . 74.22 112.022 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.415 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 80.6 p -58.63 -41.57 86.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.789 0.328 . . . . 75.55 111.075 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.6 t -59.17 -26.37 64.72 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 112.268 0.47 . . . . 72.01 112.268 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.6 mt -54.3 -37.77 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.478 0.547 . . . . 74.35 112.478 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.432 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 44.4 mt-10 -71.71 -52.88 7.75 Favored Pre-proline 0 CA--C 1.548 0.873 0 N-CA-C 112.418 0.525 . . . . 75.02 112.418 -176.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.415 ' HD2' ' O ' ' A' ' 116' ' ' SER . 12.0 Cg_endo -57.57 -30.01 87.04 Favored 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 121.629 1.553 . . . . 65.33 111.961 172.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.45 -44.55 86.9 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.906 -0.405 . . . . 70.24 109.906 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.7 -36.61 76.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.26 -0.427 . . . . 61.03 111.104 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.11 -43.7 98.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.574 -0.285 . . . . 64.34 110.655 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -60.86 -44.78 96.57 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 120.764 0.316 . . . . 65.53 111.415 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.9 mm -55.57 -52.43 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.448 0.642 . . . . 72.41 111.094 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.1 m -67.78 -34.9 77.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.387 -0.824 . . . . 75.23 111.604 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 10.2 t70 -62.95 -52.45 62.98 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.471 -0.331 . . . . 73.21 110.709 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.433 HG22 ' HB2' ' A' ' 81' ' ' MET . 90.0 t -58.21 -35.03 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.43 0.633 . . . . 75.13 111.002 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.563 ' HG ' HD11 ' A' ' 137' ' ' LEU . 22.4 tp -65.24 -53.57 42.43 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.724 -0.671 . . . . 62.01 111.205 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -77.99 -29.01 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 N-CA-C 112.414 0.524 . . . . 72.22 112.414 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 20.7 tpp180 -49.21 -40.3 33.04 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 112.564 0.579 . . . . 64.25 112.564 -174.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.653 HG21 ' HD3' ' A' ' 133' ' ' LYS . 1.3 t -130.64 -25.62 2.34 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.847 0.684 . . . . 64.43 112.847 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.653 ' HD3' HG21 ' A' ' 132' ' ' THR . 0.0 OUTLIER -95.6 17.55 14.62 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.65 -0.656 . . . . 73.41 111.968 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -45.41 -55.96 5.51 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.994 0.426 . . . . 75.14 111.894 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 5.3 m-20 -66.96 -50.62 61.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.223 -0.444 . . . . 63.52 111.163 -178.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -52.53 -36.74 56.11 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 111.967 0.358 . . . . 75.25 111.967 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.563 HD11 ' HG ' ' A' ' 129' ' ' LEU . 28.9 mt -57.58 -53.12 61.73 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.033 0.383 . . . . 72.1 112.033 177.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.5 p -77.16 -41.95 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 111.911 0.337 . . . . 74.32 111.911 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 75.4 mmtt -57.26 -49.88 74.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.995 0.426 . . . . 71.12 111.712 -179.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -95.17 2.42 55.02 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.016 0.376 . . . . 71.13 112.016 -177.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 57.7 mtt85 55.59 58.25 4.68 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.943 0.401 . . . . 74.53 111.382 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.3 -57.58 4.25 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 115.097 0.799 . . . . 62.33 115.097 -172.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -66.95 -26.26 66.74 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.402 0.519 . . . . 73.52 112.402 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.18 -51.22 7.68 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.871 0.367 . . . . 74.14 111.222 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.94 88.6 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 116.359 -0.382 . . . . 72.51 113.196 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -53.59 -47.38 70.19 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.109 0.481 . . . . 73.03 111.887 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.29 -46.96 95.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 116.08 -0.509 . . . . 51.13 112.007 -178.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.36 -27.15 61.33 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.08 0.4 . . . . 75.42 112.08 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -56.71 -48.99 76.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.909 0.385 . . . . 75.52 111.443 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.32 -14.83 52.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.012 0.434 . . . . 72.41 111.25 174.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 44.9 t60 68.19 85.25 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.685 0.794 . . . . 54.43 112.07 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.41 HG11 ' NH1' ' A' ' 46' ' ' ARG . 64.7 t . . . . . 0 CA--C 1.537 0.48 0 CA-C-N 115.793 -0.639 . . . . 72.14 111.247 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 120.863 0.363 . . . . 63.23 111.045 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -59.09 -30.61 68.21 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.036 0.446 . . . . 74.14 110.535 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.417 HD22 ' HB ' ' A' ' 138' ' ' VAL . 58.5 tp -61.91 -43.52 98.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.105 -0.498 . . . . 72.54 110.859 173.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -63.19 -48.58 77.73 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.335 -0.393 . . . . 74.31 110.669 178.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -58.71 -39.35 80.54 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.943 0.349 . . . . 72.33 111.943 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 37' ' ' SER . 7.9 tp60 -63.73 -52.39 60.69 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 74.12 111.02 176.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 m -59.43 -46.09 89.71 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.024 -0.534 . . . . 72.11 111.197 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.0 tp -61.75 -38.98 89.99 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.949 -0.568 . . . . 73.44 111.476 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.44 -51.25 70.19 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.329 0.585 . . . . 65.24 110.892 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.5 mt -61.45 -54.32 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.542 -0.754 . . . . 72.22 111.597 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.1 mt -64.13 -46.28 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 116.031 -0.531 . . . . 71.13 112.097 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -56.99 -52.12 66.53 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.768 0.318 . . . . 74.43 111.727 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 15' ' ' ARG . 48.5 mtt180 -66.19 -32.61 74.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.727 0.269 . . . . 73.4 111.727 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -62.63 -54.66 36.24 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 122.101 -0.375 . . . . 75.54 110.849 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -55.66 -45.01 77.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.699 0.285 . . . . 74.11 111.343 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -62.64 -63.35 1.25 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.478 0.547 . . . . 71.31 112.478 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 65.2 mm-40 -58.25 -34.86 70.93 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 112.649 0.611 . . . . 74.2 112.649 -174.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -80.33 -27.55 38.36 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.9 -0.5 . . . . 71.35 111.913 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.5 -33.75 69.52 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.151 0.501 . . . . 61.44 110.874 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.8 p -87.31 -30.31 20.94 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.021 -0.536 . . . . 63.32 111.418 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.877 0 C-N-CA 121.302 -0.475 . . . . 61.14 112.644 -178.016 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.688 0 N-CA-C 114.052 0.381 . . . . 74.14 114.052 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.612 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -58.6 -51.4 70.05 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.879 0.325 . . . . 63.42 111.879 -177.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.9 m -57.86 -38.79 76.33 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.825 0.345 . . . . 71.21 111.604 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 23.0 t -65.12 -51.33 61.93 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.448 -0.342 . . . . 52.11 111.319 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -58.67 -45.97 88.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.576 -0.284 . . . . 72.43 111.592 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.612 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 18.1 mtpp -56.08 -48.32 76.32 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.936 0.398 . . . . 74.12 110.969 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.94 -43.65 98.41 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.36 -0.382 . . . . 63.52 111.447 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.9 tp -59.42 -53.32 59.57 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.158 0.429 . . . . 75.41 112.158 -179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.91 -31.47 71.27 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.234 -0.291 . . . . 43.21 111.655 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.51 HG23 HG21 ' A' ' 152' ' ' VAL . 98.6 m -64.89 -43.01 94.3 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.814 0.34 . . . . 73.31 110.266 173.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.1 mt -54.12 -39.03 66.07 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.389 -0.369 . . . . 71.11 111.185 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -67.96 -45.8 73.2 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.765 0.317 . . . . 72.32 111.626 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.1 ttm-85 -61.0 -45.29 95.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.376 0.51 . . . . 74.11 112.376 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.3 m -87.52 -33.74 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.073 0.463 . . . . 72.33 111.321 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.401 ' HA2' ' HB ' ' A' ' 51' ' ' VAL . . . -69.44 -23.58 76.43 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.298 -0.477 . . . . 63.44 113.634 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.64 -53.78 34.99 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 117.183 0.492 . . . . 60.32 110.911 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.29 -44.38 28.51 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.061 -0.518 . . . . 62.04 113.017 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.401 ' HB ' ' HA2' ' A' ' 48' ' ' GLY . 76.8 t -57.29 -46.06 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 112.527 0.565 . . . . 73.33 112.527 -176.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.425 ' HG2' ' HG ' ' A' ' 100' ' ' SER . 75.1 mt-30 -57.31 -44.2 83.95 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 122.11 -0.369 . . . . 73.34 111.274 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -67.42 -54.11 23.21 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.47 0.545 . . . . 74.4 112.47 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -70.58 -20.06 62.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.208 0.447 . . . . 74.41 112.208 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.537 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 64.3 m-70 -90.3 -26.23 20.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.269 -0.269 . . . . 65.11 111.468 171.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.595 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 35.4 tt0 -53.08 -55.43 23.96 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.87 0.367 . . . . 70.24 111.518 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -56.4 -28.18 58.56 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.225 -0.443 . . . . 63.02 111.902 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.5 -44.63 20.86 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.904 0.383 . . . . 72.02 111.556 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.537 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.8 m-85 -70.8 -22.82 62.31 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.822 0.305 . . . . 65.35 111.822 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.449 ' NE2' ' HZ ' ' A' ' 104' ' ' PHE . 69.9 mm-40 -49.29 -35.88 19.28 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.966 0.412 . . . . 75.52 111.38 174.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.23 -30.43 70.83 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 121.267 -0.492 . . . . 60.42 112.988 177.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 72.8 mtm -89.11 -47.35 8.16 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.463 -0.433 . . . . 70.02 111.696 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.534 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 9.7 mp -56.85 -34.04 67.41 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.981 -0.449 . . . . 75.0 112.168 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -63.3 -17.42 62.52 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 120.831 0.348 . . . . 73.14 111.808 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -113.92 1.67 14.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.718 0.294 . . . . 72.42 111.145 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.534 ' HB2' ' HA ' ' A' ' 63' ' ' LEU . 91.2 mt -102.94 -73.97 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.516 0.327 . . . . 64.04 111.286 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 40.95 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.79 -0.641 . . . . 72.53 112.065 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.485 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.7 mp -59.6 104.99 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.715 -0.675 . . . . 64.32 112.161 -173.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.54 -4.99 15.21 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.757 -0.656 . . . . 52.24 112.173 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.417 HD21 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -159.04 169.57 23.99 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.02 0.438 . . . . 43.03 111.798 173.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.67 -36.72 69.91 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.732 0.641 . . . . 73.41 112.732 -175.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -55.19 -35.05 64.41 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 111.689 0.255 . . . . 74.45 111.689 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.468 ' HB3' HG13 ' A' ' 68' ' ' ILE . 67.6 m-20 -62.56 -42.69 99.7 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.904 0.383 . . . . 74.35 110.81 176.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.9 t -60.81 -43.05 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.171 0.51 . . . . 74.23 110.637 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -65.78 -29.47 69.97 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.227 -0.442 . . . . 74.31 111.112 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.5 m -68.42 -37.71 80.56 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.83 0.348 . . . . 75.15 110.586 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.513 ' O ' ' HG2' ' A' ' 81' ' ' MET . 98.5 mt -58.45 -33.14 69.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.36 -0.382 . . . . 64.43 111.194 175.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -52.27 -41.4 62.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.857 0.36 . . . . 71.42 111.591 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.62 -37.47 84.08 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.396 -0.366 . . . . 72.15 111.614 178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.61 -41.65 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.976 0.417 . . . . 45.43 110.942 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.513 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.3 mmt -55.02 -42.75 72.99 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.016 -0.538 . . . . 54.43 111.487 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 82.0 mt -58.54 -40.96 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.201 -0.454 . . . . 72.51 111.237 175.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -67.98 -26.83 66.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.18 0.437 . . . . 74.41 112.18 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.525 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 62.1 t -56.7 -25.37 21.39 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.149 0.499 . . . . 61.13 110.993 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.45 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.3 m-85 . . . . . 0 CA--C 1.541 0.606 0 N-CA-C 112.808 0.67 . . . . 72.12 112.808 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.523 ' HE3' HG13 ' A' ' 95' ' ' ILE . 93.4 m95 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 112.147 0.425 . . . . 73.53 112.147 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.42 -24.83 56.87 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.461 -0.4 . . . . 50.54 113.296 177.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.563 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 2.8 mmp_? -67.26 -33.04 74.47 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.462 -0.434 . . . . 75.54 111.255 176.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.523 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.1 mm -63.8 -46.11 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.303 0.573 . . . . 74.24 109.669 173.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -57.59 -44.43 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.704 -0.68 . . . . 64.44 110.904 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.0 m -61.57 -44.85 96.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.324 -0.398 . . . . 72.31 111.259 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.575 ' HG ' HG22 ' A' ' 125' ' ' ILE . 41.9 tp -58.49 -54.92 41.65 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.236 0.541 . . . . 71.11 111.209 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.2 mt -65.65 -32.58 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 115.98 -0.555 . . . . 74.22 111.221 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.425 ' HG ' ' HG2' ' A' ' 52' ' ' GLN . 29.6 t -64.36 -48.46 75.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 116.503 -0.317 . . . . 75.33 111.449 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.429 ' O ' HG22 ' A' ' 105' ' ' VAL . 14.3 t80 -61.39 -43.13 99.39 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.84 0.353 . . . . 74.33 110.582 177.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.73 -44.51 95.74 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 120.932 -0.652 . . . . 73.45 112.481 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.36 94.22 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.689 0.28 . . . . 44.25 111.484 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.595 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 16.0 t80 -64.83 -45.53 85.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.805 0.336 . . . . 74.32 111.429 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.543 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.7 t -64.42 -37.94 81.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 121.973 -0.454 . . . . 74.14 110.023 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . 0.403 ' HA ' HD13 ' A' ' 109' ' ' LEU . . . -61.15 -50.69 72.16 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.338 0.496 . . . . 74.34 112.338 179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.69 -35.59 76.67 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.15 -0.344 . . . . 73.1 111.004 178.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.427 ' O ' HG12 ' A' ' 112' ' ' ILE . 86.6 t60 -68.05 -35.28 77.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.751 0.31 . . . . 70.52 110.627 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 85.7 mt -60.77 -49.47 77.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.654 -0.248 . . . . 73.12 111.057 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -62.79 -38.19 89.68 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.789 0.328 . . . . 73.41 110.93 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 99.6 m -53.6 -38.33 63.88 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.126 0.489 . . . . 73.02 111.084 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -103.59 19.5 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 116.361 -0.382 . . . . 72.41 111.921 177.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 57.03 59.17 3.57 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.324 0.583 . . . . 70.24 112.396 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -131.17 33.89 4.08 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.915 -0.584 . . . . 74.21 110.984 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.77 -33.23 66.41 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.518 0.562 . . . . 74.31 112.518 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.0 m -54.98 -27.28 42.78 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 120.791 0.329 . . . . 74.51 111.606 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.0 t -79.18 -27.18 42.61 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.022 0.379 . . . . 42.4 112.022 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.64 -45.14 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 112.807 0.669 . . . . 70.23 112.807 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.76 -53.32 44.44 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 112.712 0.634 . . . . 65.42 112.712 -176.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.34 -27.23 82.74 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 121.598 1.532 . . . . 61.51 112.216 174.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -66.08 -44.43 84.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.362 -0.607 . . . . 74.43 109.362 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.11 -37.85 81.24 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.134 -0.485 . . . . 60.51 110.842 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.85 -40.03 93.91 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.221 -0.445 . . . . 64.45 110.79 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 61.6 m -62.96 -45.42 92.51 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.787 0.327 . . . . 73.2 111.246 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.575 HG22 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.7 -52.31 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 121.5 0.667 . . . . 74.35 110.669 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -68.24 -33.46 74.43 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.225 -0.898 . . . . 61.44 111.582 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 31.1 t70 -65.05 -51.97 58.47 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.744 -0.207 . . . . 75.42 111.282 -176.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 89.3 t -59.8 -41.92 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.275 0.56 . . . . 63.4 110.549 176.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.548 ' HG ' HD13 ' A' ' 137' ' ' LEU . 55.0 tp -55.97 -53.34 58.13 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.51 -0.768 . . . . 60.24 111.611 176.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 68.8 t -75.25 -26.52 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 115.902 -0.59 . . . . 73.53 111.843 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 18.7 tpt180 -57.31 -37.32 72.31 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.005 0.372 . . . . 72.53 112.005 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.6 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.7 t -125.07 -38.68 2.3 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.82 0.674 . . . . 72.15 112.82 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.6 ' HG2' HG23 ' A' ' 132' ' ' THR . 33.0 mmtp -105.04 20.01 19.61 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.767 0.654 . . . . 53.34 112.767 -173.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 46.6 ttp180 -54.68 -54.27 43.96 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.232 0.539 . . . . 65.12 111.365 176.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -53.25 -44.81 68.43 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.533 -0.758 . . . . 72.41 111.659 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -62.38 -38.22 88.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 111.776 0.287 . . . . 72.11 111.776 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.548 HD13 ' HG ' ' A' ' 129' ' ' LEU . 40.9 mt -56.44 -50.07 72.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.614 0.245 . . . . 72.43 111.605 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . 0.417 ' HB ' HD22 ' A' ' 5' ' ' LEU . 8.1 p -77.19 -43.46 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 112.101 0.408 . . . . 72.0 112.101 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -62.36 -60.34 3.69 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.962 0.411 . . . . 71.54 111.808 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -81.97 -2.99 53.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.606 -0.27 . . . . 72.3 111.648 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 70.9 mtt180 57.14 61.76 2.45 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.181 -0.463 . . . . 71.24 110.836 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -51.21 -45.1 52.29 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.703 -0.68 . . . . 74.01 114.635 -173.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -72.85 -23.81 60.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.363 0.581 . . . . 74.12 111.786 -176.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -81.74 -47.37 13.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.301 0.572 . . . . 75.12 110.215 173.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.421 ' HA2' ' CG ' ' A' ' 148' ' ' GLU . . . -62.84 -30.71 77.99 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.778 -0.646 . . . . 37.73 113.369 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -58.76 -40.56 84.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.997 0.427 . . . . 64.14 111.58 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 48.6 t -73.57 -41.75 55.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.307 -0.406 . . . . 74.14 112.056 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.421 ' CG ' ' HA2' ' A' ' 145' ' ' GLY . 0.0 OUTLIER -73.39 -31.63 64.0 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.714 0.635 . . . . 61.22 112.714 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.04 -48.72 80.57 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.036 0.446 . . . . 70.54 111.487 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -83.8 -15.08 49.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.324 -0.398 . . . . 73.05 111.387 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 76.3 t60 55.77 68.24 0.89 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.593 0.711 . . . . 64.45 111.114 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.51 HG21 HG23 ' A' ' 43' ' ' THR . 69.5 t . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 115.632 -0.713 . . . . 73.24 112.631 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 CA--C 1.542 0.655 0 CA-C-O 120.999 0.428 . . . . 62.44 111.959 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -63.69 -45.55 89.55 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.492 -0.322 . . . . 70.54 111.839 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 137' ' ' LEU . 65.1 tp -61.02 -39.9 91.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.022 0.439 . . . . 75.41 111.146 -178.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -59.25 -47.91 83.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.202 -0.454 . . . . 75.23 110.951 174.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -44.36 94.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 111.939 0.348 . . . . 72.02 111.939 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -56.57 -52.44 64.8 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.256 0.551 . . . . 73.33 110.736 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.9 m -61.85 -43.78 98.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.775 -0.648 . . . . 75.13 111.261 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.1 -46.71 85.07 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.284 -0.416 . . . . 75.35 111.544 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -58.07 -51.17 70.79 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.935 0.398 . . . . 73.42 111.151 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.5 mt -58.62 -50.67 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.004 0.43 . . . . 74.1 111.672 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.455 HD13 HG23 ' A' ' 125' ' ' ILE . 84.7 mt -65.94 -48.77 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.217 -0.447 . . . . 63.24 111.818 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -55.34 -46.61 76.39 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.891 0.377 . . . . 71.35 110.845 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 3.3 mtt85 -53.86 -57.07 12.29 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.15 -0.477 . . . . 73.51 111.285 174.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -53.84 -45.33 70.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.394 0.516 . . . . 72.3 112.394 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.23 -45.77 87.1 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.826 0.346 . . . . 75.41 111.292 177.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.7 mmm180 -61.49 -48.34 81.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.894 0.378 . . . . 74.33 111.296 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 18.6 mm-40 -56.15 -51.63 67.29 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.129 0.49 . . . . 74.5 111.803 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.476 ' HA ' HE21 ' A' ' 20' ' ' GLN . 0.1 OUTLIER -70.92 -36.25 72.59 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.161 -0.472 . . . . 73.22 112.094 -176.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.5 72.83 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.043 0.386 . . . . 60.2 112.043 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.5 p -95.2 -17.06 22.06 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.338 0.496 . . . . 74.33 112.338 -178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 121.228 -0.511 . . . . 60.3 113.236 179.909 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.036 0 N-CA-C 114.265 0.466 . . . . 62.45 114.265 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.9 -49.66 72.8 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.635 0.976 . . . . 72.52 113.635 -172.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.5 m -56.33 -46.23 80.02 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.949 0.351 . . . . 75.14 111.949 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.2 p -63.67 -44.43 93.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.892 0.377 . . . . 73.24 111.302 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.8 mtp180 -63.67 -54.04 41.9 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.1 0.408 . . . . 75.42 112.1 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HG3' HG21 ' A' ' 147' ' ' VAL . 0.2 OUTLIER -56.75 -37.93 71.72 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.814 0.34 . . . . 71.44 110.879 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.29 72.98 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.857 0.361 . . . . 73.13 111.445 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 44.2 tp -63.96 -44.93 91.28 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.423 -0.353 . . . . 65.42 111.828 -178.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.25 -34.49 78.12 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 122.181 -0.324 . . . . 74.3 110.677 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 89.7 m -61.22 -46.58 89.85 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.738 0.304 . . . . 72.2 110.385 172.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -53.99 -31.64 51.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.441 -0.345 . . . . 72.43 111.673 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 41' ' ' LEU . 65.3 mtt-85 -72.64 -54.88 7.84 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 122.031 -0.418 . . . . 74.11 111.272 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.434 ' NH1' HG11 ' A' ' 152' ' ' VAL . 15.8 ptm180 -63.69 -43.87 95.36 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.502 0.556 . . . . 75.41 112.502 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 43' ' ' THR . 10.7 m -87.23 -33.63 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 122.119 -0.363 . . . . 72.53 111.824 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.42 -48.33 58.22 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 120.831 -0.7 . . . . 72.42 112.808 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.585 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.0 t70 -57.27 -52.28 65.95 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.912 0.387 . . . . 71.31 110.719 176.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.21 -52.1 46.26 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 121.189 -0.529 . . . . 54.22 112.857 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.43 HG22 HG12 ' A' ' 96' ' ' VAL . 63.4 t -58.04 -43.43 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 111.726 0.269 . . . . 73.13 111.726 178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.443 ' HG3' ' HG ' ' A' ' 100' ' ' SER . 44.6 mt-30 -55.73 -45.77 77.91 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.65 0.262 . . . . 60.54 111.52 177.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 53.2 mtp85 -66.81 -37.73 85.1 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.729 0.64 . . . . 74.02 112.729 -173.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.448 ' OD1' ' HD2' ' A' ' 55' ' ' HIS . 8.5 p30 -85.87 -22.15 27.67 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.592 -0.693 . . . . 73.25 112.142 177.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.448 ' HD2' ' OD1' ' A' ' 54' ' ' ASN . 12.9 m170 -86.43 -21.87 26.86 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.161 -0.337 . . . . 71.53 111.775 175.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.92 -48.46 60.69 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.414 0.524 . . . . 73.51 112.414 -176.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.7 t -56.3 -28.4 58.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.135 0.493 . . . . 75.41 112.079 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.57 -38.32 23.85 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.948 0.404 . . . . 64.3 111.718 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -76.23 -33.16 59.21 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.624 0.601 . . . . 71.52 112.624 -176.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 63.5 mm-40 -46.29 -56.52 5.67 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.603 0.594 . . . . 73.54 112.603 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.99 -22.65 58.12 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 121.367 -0.444 . . . . 44.42 114.139 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.545 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 26.4 mtm -87.4 -36.54 17.7 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 122.032 -0.687 . . . . 72.24 109.44 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.462 HD21 ' CE2' ' A' ' 104' ' ' PHE . 12.3 tp -60.1 -33.1 71.65 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.522 -0.763 . . . . 62.41 110.953 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 54.3 mtt85 -65.47 -42.78 91.89 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.741 -0.663 . . . . 74.42 112.056 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.545 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -77.1 -15.64 59.49 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.786 0.326 . . . . 75.1 110.781 177.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 62' ' ' MET . 95.8 mt -81.95 -80.82 0.15 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.342 -0.39 . . . . 61.24 111.27 175.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.2 t70 45.24 90.44 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.34 0.656 . . . . 61.23 111.647 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.52 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.8 mp -68.55 102.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.244 0.545 . . . . 55.54 111.619 -175.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -12.03 27.81 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.128 -0.487 . . . . 70.35 111.892 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.0 175.16 11.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.043 0.449 . . . . 63.34 112.02 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -50.83 -36.99 40.31 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.881 -0.6 . . . . 72.3 112.494 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.543 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 37.7 t70 -56.87 -39.71 74.85 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 111.879 0.325 . . . . 73.24 111.879 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.506 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.0 m-20 -63.18 -36.07 82.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.883 0.373 . . . . 65.13 110.814 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.13 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.075 0.464 . . . . 65.3 110.511 175.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.543 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 9.6 mtmp? -63.96 -29.94 71.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.009 0.433 . . . . 75.31 110.821 175.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -67.57 -40.47 84.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.016 0.436 . . . . 65.23 110.618 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.1 mt -58.78 -34.73 71.77 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.402 -0.363 . . . . 71.24 111.211 176.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 82' ' ' ILE . 47.0 m -52.16 -37.75 55.52 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.941 0.4 . . . . 65.22 110.945 176.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.467 ' HD3' HD11 ' A' ' 82' ' ' ILE . 31.0 mmt180 -64.07 -48.87 74.54 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.315 -0.402 . . . . 75.31 111.399 175.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 86.8 t -55.29 -40.99 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.116 0.484 . . . . 61.14 110.489 175.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.2 mmt -60.79 -38.57 85.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.85 -0.614 . . . . 72.2 111.436 177.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.467 HD11 ' HD3' ' A' ' 79' ' ' ARG . 85.5 mt -61.32 -38.36 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-O 121.027 0.442 . . . . 72.55 110.623 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.411 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 63.0 m-70 -68.8 -28.8 67.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.383 -0.371 . . . . 74.31 111.47 175.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 95.1 t -61.37 -34.48 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.919 0.39 . . . . 75.33 111.183 174.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.506 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 22.8 m-85 . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 112.012 0.375 . . . . 75.32 112.012 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.519 ' HE3' HG13 ' A' ' 95' ' ' ILE . 95.9 m95 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 112.761 0.652 . . . . 74.14 112.761 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.05 -25.06 53.08 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 121.228 -0.51 . . . . 60.21 112.86 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -70.57 -35.58 73.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.519 -0.401 . . . . 71.51 111.046 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.519 HG13 ' HE3' ' A' ' 92' ' ' TRP . 45.3 mm -62.73 -45.31 99.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.31 0.576 . . . . 72.41 110.037 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.43 HG12 HG22 ' A' ' 51' ' ' VAL . 43.5 t -56.02 -47.4 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 115.657 -0.702 . . . . 63.33 110.75 174.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 94.3 m -55.13 -44.14 74.79 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.537 -0.301 . . . . 74.23 111.517 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.538 ' HG ' HG22 ' A' ' 125' ' ' ILE . 22.2 tp -58.46 -55.67 32.07 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.396 0.617 . . . . 65.31 111.648 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 55.8 mt -71.09 -32.56 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.784 -0.644 . . . . 64.53 111.317 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.443 ' HG ' ' HG3' ' A' ' 52' ' ' GLN . 40.4 t -61.6 -52.05 66.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.892 -0.594 . . . . 74.43 111.244 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.476 ' O ' HG21 ' A' ' 105' ' ' VAL . 23.4 t80 -63.95 -35.99 82.48 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.692 0.282 . . . . 75.21 110.87 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.08 -48.67 84.95 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 120.985 -0.626 . . . . 72.01 112.574 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.46 83.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.859 0.361 . . . . 74.51 111.348 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.462 ' CE2' HD21 ' A' ' 63' ' ' LEU . 78.3 t80 -60.72 -46.65 89.59 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.387 -0.369 . . . . 74.11 111.232 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 101' ' ' PHE . 58.0 t -64.88 -37.33 79.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 120.908 0.385 . . . . 74.12 110.512 175.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.73 -39.22 70.83 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.112 -0.495 . . . . 75.25 111.496 176.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -56.08 -49.27 74.26 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.359 0.6 . . . . 72.32 110.653 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.517 ' O ' HG12 ' A' ' 112' ' ' ILE . 58.3 t60 -63.35 -41.9 98.89 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.725 -0.671 . . . . 73.33 111.016 -179.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.52 HD21 ' HB ' ' A' ' 68' ' ' ILE . 88.5 mt -63.11 -49.96 72.4 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.062 0.458 . . . . 75.51 111.451 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -59.67 -30.26 68.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.667 -0.697 . . . . 75.53 110.63 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.5 m -77.31 -48.75 16.58 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.008 -0.542 . . . . 70.53 112.246 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 108' ' ' HIS . 42.2 pt -83.79 24.32 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 112.681 0.623 . . . . 73.33 112.681 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 62.4 18.09 10.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.549 0.574 . . . . 61.14 112.549 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -102.88 31.41 4.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.24 0.543 . . . . 62.51 110.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.26 -33.58 67.75 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.675 -0.693 . . . . 53.52 112.386 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 62.3 m -56.34 -32.75 64.98 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 120.886 0.374 . . . . 61.4 111.772 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.425 ' HB2' HD12 ' A' ' 109' ' ' LEU . 48.2 m -62.29 -26.76 68.59 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.223 0.453 . . . . 75.34 112.223 -179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.27 -44.22 74.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.849 0.685 . . . . 53.31 112.849 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -64.04 -53.76 45.66 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 112.52 0.563 . . . . 64.15 112.52 -175.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.34 -28.05 71.77 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.833 1.689 . . . . 73.35 112.276 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.42 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.2 tt -61.86 -40.68 96.22 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.99 0.424 . . . . 74.02 109.994 175.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.76 -33.83 73.53 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.239 -0.437 . . . . 75.13 111.233 175.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.344 -0.389 . . . . 63.12 110.908 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.8 m -59.01 -45.33 90.96 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.956 0.408 . . . . 38.29 111.276 175.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.538 HG22 ' HG ' ' A' ' 98' ' ' LEU . 44.5 mm -57.27 -53.17 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.213 0.53 . . . . 71.1 111.09 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 36.7 m -65.55 -38.52 89.83 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.798 -0.637 . . . . 61.05 111.91 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 29.5 t70 -59.39 -51.83 68.22 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.602 0.239 . . . . 64.44 111.226 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.492 HG23 ' HB2' ' A' ' 81' ' ' MET . 67.8 t -63.9 -39.62 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.928 0.394 . . . . 71.11 111.086 178.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.446 ' HG ' HD13 ' A' ' 137' ' ' LEU . 45.3 tp -55.63 -52.47 63.7 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.324 0.583 . . . . 73.0 110.902 176.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 95.0 t -72.76 -30.44 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.806 -0.633 . . . . 71.31 111.633 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 2.0 tpt180 -57.36 -30.26 64.7 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.116 0.413 . . . . 74.14 112.116 -175.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.609 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.1 OUTLIER -130.18 -30.78 1.93 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.451 0.908 . . . . 72.23 113.451 -176.887 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.609 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.4 mptp? -112.36 23.83 13.2 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.425 -0.797 . . . . 74.22 113.007 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 16.2 ttp180 -53.85 -65.39 0.58 Allowed 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.666 0.746 . . . . 61.05 112.187 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.93 -31.6 71.94 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.154 -0.93 . . . . 62.24 111.097 -173.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -68.6 -35.82 77.87 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.404 -0.362 . . . . 75.54 111.621 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.534 ' HB2' HD22 ' A' ' 5' ' ' LEU . 52.6 mt -54.64 -45.6 73.82 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 120.555 0.217 . . . . 72.24 111.534 175.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.3 p -78.88 -43.78 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 112.329 0.492 . . . . 51.12 112.329 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -60.87 -57.76 11.29 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.128 0.489 . . . . 73.24 112.167 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -87.61 1.41 53.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.5 -0.318 . . . . 71.44 111.514 -177.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 58.15 62.2 2.1 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.306 -0.406 . . . . 72.14 110.507 -178.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 146' ' ' PHE . . . -42.85 -52.56 5.58 Favored Glycine 0 C--O 1.223 -0.545 0 CA-C-N 115.689 -0.687 . . . . 74.15 114.319 -174.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -72.04 -21.06 61.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.439 0.533 . . . . 74.0 112.439 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -84.82 -58.22 2.8 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.1 0.476 . . . . 71.34 110.66 174.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.563 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -56.84 -32.04 61.65 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 115.978 -0.555 . . . . 61.3 113.112 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . 0.407 ' HB2' ' O ' ' A' ' 142' ' ' GLY . 80.3 t80 -54.88 -39.26 68.51 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.317 0.58 . . . . 70.12 111.14 174.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.531 HG21 ' HG3' ' A' ' 39' ' ' LYS . 96.2 t -73.51 -43.2 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 115.721 -0.672 . . . . 74.0 112.263 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.563 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 10.0 pt-20 -73.31 -33.75 65.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 111.934 0.346 . . . . 53.12 111.934 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -56.66 -48.2 78.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.1 0.476 . . . . 74.31 111.232 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.49 -5.35 59.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 74.22 111.688 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 60.74 50.44 5.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.546 0.689 . . . . 74.44 111.917 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.451 HG22 ' OG1' ' A' ' 43' ' ' THR . 97.4 t . . . . . 0 CA--C 1.54 0.574 0 CA-C-N 115.468 -0.787 . . . . 74.23 112.171 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 . . . . . 0 CA--C 1.545 0.776 0 CA-C-O 120.456 0.169 . . . . 70.35 111.287 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.71 -46.03 81.49 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.242 0.544 . . . . 74.41 111.496 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 137' ' ' LEU . 59.8 tp -68.96 -33.5 73.8 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.218 -0.447 . . . . 62.45 110.69 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -59.88 -47.19 86.78 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.246 -0.434 . . . . 65.14 109.954 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -57.04 -49.64 75.21 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.965 0.358 . . . . 73.03 111.965 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.602 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 60.6 tt0 -62.53 -48.17 80.72 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.426 0.631 . . . . 63.1 111.475 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 m -59.86 -32.09 70.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.117 0.484 . . . . 54.2 110.751 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -72.75 -46.22 54.55 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.131 -0.486 . . . . 73.34 111.865 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.602 ' HG2' ' O ' ' A' ' 8' ' ' GLN . 14.1 pt-20 -57.59 -43.07 84.33 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.965 0.412 . . . . 63.24 110.765 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 67.1 mt -65.15 -54.7 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 116.053 -0.521 . . . . 72.4 111.895 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.402 HD11 HG23 ' A' ' 125' ' ' ILE . 76.5 mt -66.4 -51.16 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.836 0.35 . . . . 75.31 111.857 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.517 ' HA ' ' HB1' ' A' ' 122' ' ' ALA . 47.7 t -50.04 -51.27 43.55 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.229 -0.441 . . . . 72.42 111.559 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 28.0 mtp180 -58.75 -45.99 88.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 120.853 -0.339 . . . . 74.1 111.517 176.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -53.43 -44.18 68.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.882 0.327 . . . . 74.02 111.882 -176.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -62.22 -42.65 99.5 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.815 -0.175 . . . . 63.42 111.348 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.561 ' NH2' ' HG2' ' A' ' 119' ' ' GLU . 8.4 mpt_? -61.55 -48.26 81.79 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.689 0.28 . . . . 70.51 111.34 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 16.1 mm-40 -54.45 -46.81 73.36 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.415 0.626 . . . . 74.23 111.062 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.68 ' HG3' ' HE2' ' A' ' 107' ' ' LYS . 8.6 tp-100 -75.64 -43.05 49.75 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.761 -0.654 . . . . 73.33 112.369 -175.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.27 80.38 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.251 0.463 . . . . 61.43 112.251 -177.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.8 p -87.02 -28.62 22.51 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.799 0.333 . . . . 64.55 111.644 -177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.61 0 C-N-CA 121.213 -0.517 . . . . 72.11 112.875 179.924 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.892 0 N-CA-C 113.783 0.273 . . . . 75.11 113.783 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.88 -50.13 61.6 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.862 0.69 . . . . 72.23 112.862 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.512 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 90.5 m -64.3 -40.48 96.02 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.866 0.365 . . . . 75.13 111.635 -177.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.2 m -66.06 -42.19 89.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.712 0.291 . . . . 53.22 111.453 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -68.87 -52.77 26.14 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.627 0.251 . . . . 74.41 111.335 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HB2' HG11 ' A' ' 147' ' ' VAL . 20.6 ptmt -54.97 -39.49 69.03 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.958 0.409 . . . . 62.55 110.556 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.1 -53.2 33.05 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.261 -0.427 . . . . 74.33 111.706 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.539 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.0 tp -59.55 -40.51 87.49 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.521 0.563 . . . . 75.3 112.521 -176.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.405 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 12.3 pt-20 -73.4 -41.39 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.273 -0.267 . . . . 75.24 111.442 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.438 ' O ' HG23 ' A' ' 47' ' ' VAL . 82.7 m -69.26 -34.34 74.63 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 122.097 -0.377 . . . . 65.01 111.275 178.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -56.51 -44.05 80.37 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.883 0.327 . . . . 60.4 111.883 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.539 HH21 ' HG ' ' A' ' 41' ' ' LEU . 19.2 ptp180 -78.61 -32.38 47.47 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.996 0.427 . . . . 65.32 110.962 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 46' ' ' ARG . 20.8 ttt180 -58.62 -44.88 90.11 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.061 -0.518 . . . . 75.22 111.759 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 43' ' ' THR . 32.8 m -91.66 -33.11 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.014 0.435 . . . . 74.25 111.223 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.46 -32.55 73.25 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 116.167 -0.47 . . . . 61.21 113.759 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.557 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.6 t70 -53.44 -56.65 15.08 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 117.088 0.444 . . . . 74.53 110.875 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.9 -43.79 81.63 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 121.018 -0.61 . . . . 38.63 113.066 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.7 t -57.34 -46.06 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 112.039 0.385 . . . . 74.43 112.039 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -63.12 -28.07 69.82 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.878 0.325 . . . . 75.13 111.878 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 46.9 mtt180 -69.29 -52.67 25.17 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 74.41 111.422 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -74.47 -23.06 58.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.824 0.345 . . . . 73.3 111.791 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.408 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 17.1 m170 -82.66 -22.63 34.55 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.593 0.22 . . . . 72.34 111.593 173.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 43.1 tt0 -50.71 -56.6 11.21 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.102 0.408 . . . . 74.03 112.102 -176.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.4 t -54.89 -37.9 66.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.208 0.447 . . . . 72.2 112.208 -178.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.51 -46.04 50.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.893 0.378 . . . . 70.24 111.61 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.408 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.1 m-30 -64.63 -40.22 95.07 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.307 -0.406 . . . . 75.55 111.776 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.603 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 76.4 mm-40 -44.97 -55.07 5.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 120.779 0.323 . . . . 74.15 111.446 177.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.53 -34.76 49.99 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 116.154 -0.476 . . . . 64.33 113.961 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.8 mtm -79.46 -44.18 21.83 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.15 -0.618 . . . . 63.34 111.256 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.84 -32.81 69.75 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 111.665 0.246 . . . . 71.44 111.665 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 79.5 mtp180 -59.99 -34.87 73.91 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.364 0.602 . . . . 70.44 111.34 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -84.01 -38.88 20.36 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.95 -0.568 . . . . 62.21 111.153 177.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.408 HD12 HD21 ' A' ' 77' ' ' LEU . 83.9 mt -69.56 -76.72 0.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.971 -0.559 . . . . 75.01 111.823 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 t70 43.67 85.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.312 0.577 . . . . 74.32 111.281 -172.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.499 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.7 mp -60.23 106.66 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 115.834 -0.621 . . . . 74.34 111.852 -174.028 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.77 -5.88 20.83 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.183 0.438 . . . . 71.42 112.183 -179.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.508 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -162.92 173.71 13.32 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.808 0.337 . . . . 64.42 111.865 174.912 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.28 -35.99 65.64 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.012 0.434 . . . . 72.21 111.907 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -51.55 -41.7 61.28 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.186 -0.461 . . . . 65.33 112.004 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.499 ' HB2' HG21 ' A' ' 68' ' ' ILE . 42.6 m-20 -60.47 -41.19 93.67 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.686 0.279 . . . . 74.33 111.285 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.24 -42.75 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.276 0.56 . . . . 70.21 110.936 178.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.02 -28.58 65.6 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.132 -0.485 . . . . 75.34 111.195 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -68.45 -37.31 80.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.168 0.508 . . . . 73.12 110.252 171.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 81' ' ' MET . 95.5 mt -60.43 -38.89 85.52 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.172 -0.467 . . . . 53.33 110.771 174.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.429 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.8 t -52.68 -37.92 59.67 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.121 0.486 . . . . 75.23 111.137 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -65.58 -40.33 92.6 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.514 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.93 -40.41 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.946 0.403 . . . . 72.03 110.896 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.5 mmt -57.17 -36.59 70.96 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.213 0.53 . . . . 72.42 110.759 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -62.08 -40.69 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 115.988 -0.551 . . . . 73.44 110.931 172.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -65.0 -32.6 74.41 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.007 0.373 . . . . 73.43 112.007 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.6 t -54.62 -41.21 54.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.027 0.441 . . . . 64.03 111.609 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.474 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 50.8 m-85 . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 112.016 0.376 . . . . 75.15 112.016 178.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 19.3 m95 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.993 0.425 . . . . 73.42 111.166 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.75 -29.07 71.15 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 121.04 -0.6 . . . . 38.63 112.832 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.723 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.3 mmp_? -73.07 -32.38 64.98 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.495 -0.414 . . . . 74.51 111.001 176.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.7 mm -58.82 -44.73 91.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.239 0.543 . . . . 71.14 109.933 173.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 t -58.65 -43.83 88.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.814 -0.63 . . . . 70.15 110.762 174.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.4 m -54.79 -50.43 68.54 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.034 0.445 . . . . 72.3 111.218 177.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.503 ' HG ' HG22 ' A' ' 125' ' ' ILE . 34.9 tp -60.38 -54.83 40.89 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.833 -0.622 . . . . 72.41 112.111 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.83 -41.03 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.011 0.374 . . . . 71.41 112.011 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.1 p -59.75 -42.42 93.18 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.627 0.251 . . . . 75.34 111.336 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 105' ' ' VAL . 21.7 t80 -63.05 -44.01 97.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.613 0.244 . . . . 72.22 110.932 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -45.93 93.4 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.051 -0.595 . . . . 70.25 112.917 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.91 78.71 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.035 0.445 . . . . 61.25 111.689 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -62.02 -43.43 98.86 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.024 0.44 . . . . 71.42 110.894 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 91.2 t -65.11 -38.33 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.405 -0.361 . . . . 62.51 110.678 176.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.99 -43.12 66.21 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.794 0.33 . . . . 64.21 111.609 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.68 ' HE2' ' HG3' ' A' ' 20' ' ' GLN . 61.9 mttm -56.61 -49.22 75.57 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.209 0.528 . . . . 71.14 111.295 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.499 ' O ' HG12 ' A' ' 112' ' ' ILE . 77.1 t60 -62.66 -35.38 79.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.145 -0.48 . . . . 73.14 110.938 179.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.475 HD11 ' HB2' ' A' ' 117' ' ' SER . 96.1 mt -62.73 -49.52 74.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.34 -0.391 . . . . 74.23 110.977 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.46 ' HA ' ' HG3' ' A' ' 115' ' ' GLU . 85.8 tttt -57.99 -41.53 83.2 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.312 -0.403 . . . . 72.01 111.569 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 96.4 m -59.86 -41.58 91.8 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.13 -0.486 . . . . 63.3 111.849 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.5 pt -94.53 23.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.099 0.407 . . . . 74.44 112.099 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 70.37 1.36 3.57 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.096 0.776 . . . . 71.2 113.096 174.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 68' ' ' ILE . 15.1 mm100 -86.22 35.62 0.65 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 112.549 0.574 . . . . 71.35 112.549 -175.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.46 ' HG3' ' HA ' ' A' ' 110' ' ' LYS . 37.6 mt-10 -56.65 -31.76 64.7 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.671 0.272 . . . . 62.0 111.71 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 m -55.06 -32.35 61.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.002 0.43 . . . . 73.44 111.319 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' SER . . . . . 0.475 ' HB2' HD11 ' A' ' 109' ' ' LEU . 50.1 m -70.17 -27.72 64.75 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.138 -0.483 . . . . 70.51 112.157 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.4 mt -54.51 -41.11 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.254 0.465 . . . . 64.54 112.254 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.561 ' HG2' ' NH2' ' A' ' 18' ' ' ARG . 30.8 mt-10 -65.57 -55.91 21.56 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 112.724 0.639 . . . . 73.32 112.724 -174.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.84 -28.15 51.1 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 121.78 1.653 . . . . 63.41 112.355 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.432 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.2 tt -64.29 -45.26 88.75 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 109.87 -0.419 . . . . 71.51 109.87 175.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.517 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -57.06 -37.61 72.06 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.969 0.414 . . . . 74.13 111.196 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.51 -36.52 73.81 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.179 -0.464 . . . . 73.22 111.718 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 80.0 p -62.58 -41.2 98.8 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 75.23 111.318 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.503 HG22 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.02 -52.91 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 63.4 110.975 177.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.9 m -69.55 -33.61 73.01 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.843 -0.617 . . . . 75.01 111.523 178.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.57 -52.91 63.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.684 0.278 . . . . 75.14 111.371 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.41 HG22 ' HB2' ' A' ' 81' ' ' MET . 59.6 t -65.43 -41.16 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.11 0.481 . . . . 61.31 110.818 178.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.547 ' HG ' HD13 ' A' ' 137' ' ' LEU . 51.9 tp -54.81 -52.39 62.84 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.847 -0.615 . . . . 74.13 111.427 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.421 HG13 ' HD3' ' A' ' 134' ' ' ARG . 92.7 t -75.57 -26.94 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.142 -0.481 . . . . 75.21 111.708 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -60.53 -26.51 66.93 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.021 0.378 . . . . 73.23 112.021 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.564 HG21 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -131.44 -40.82 1.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.051 1.13 . . . . 71.41 114.051 -179.316 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.564 ' HD2' HG21 ' A' ' 132' ' ' THR . 3.3 mptp? -103.25 20.64 17.34 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.692 0.997 . . . . 74.54 113.692 -174.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.512 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.9 ttp180 -56.05 -51.27 68.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.293 0.497 . . . . 74.31 111.607 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -57.39 -45.78 84.14 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.298 -0.41 . . . . 73.44 111.31 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -62.99 -38.33 90.74 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.411 -0.359 . . . . 64.33 111.586 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.547 HD13 ' HG ' ' A' ' 129' ' ' LEU . 65.1 mt -56.15 -49.74 73.09 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.916 0.339 . . . . 70.01 111.916 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.2 p -78.09 -42.25 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 112.166 0.432 . . . . 74.44 112.166 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -67.59 -62.47 1.4 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.169 0.433 . . . . 74.42 112.169 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.5 -8.69 59.31 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.809 0.338 . . . . 70.42 111.441 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 137' ' ' LEU . 46.2 mtt-85 60.62 83.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.551 0.691 . . . . 75.03 111.245 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -66.61 -52.92 31.03 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 115.291 -0.868 . . . . 64.22 114.125 -174.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -68.0 -39.73 83.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.007 0.432 . . . . 73.14 111.437 -175.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -70.6 -52.8 19.03 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.788 0.327 . . . . 70.1 110.901 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -57.3 -38.87 88.88 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 116.182 -0.463 . . . . 63.34 113.446 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.57 -56.32 23.72 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.254 0.55 . . . . 73.22 111.59 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.531 HG11 ' HB2' ' A' ' 39' ' ' LYS . 90.1 t -59.93 -45.21 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.285 0.564 . . . . 72.34 112.053 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.68 -24.88 60.02 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.958 -0.565 . . . . 73.14 111.883 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -58.05 -49.1 78.04 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.051 0.453 . . . . 71.11 110.835 172.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -82.52 -3.79 56.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.995 0.368 . . . . 75.44 111.995 178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 24.1 t60 60.41 81.47 0.18 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.16 0.505 . . . . 72.41 111.702 179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.471 0.608 0 CA-C-O 121.21 0.528 . . . . 71.43 110.545 178.807 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.785 0.326 . . . . 65.23 111.547 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -55.46 -37.27 67.54 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.394 0.616 . . . . 75.14 109.928 172.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.87 -41.47 74.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.545 -0.752 . . . . 65.25 111.554 174.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -67.41 -39.97 85.56 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.93 0.395 . . . . 74.42 110.565 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -67.18 -42.74 83.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.333 -0.394 . . . . 74.41 111.539 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.463 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.1 tt0 -61.61 -52.25 65.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.836 0.351 . . . . 64.14 111.222 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 p -58.86 -52.4 65.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.156 -0.475 . . . . 61.1 111.253 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.484 HD12 ' HG2' ' A' ' 123' ' ' GLU . 46.1 tp -54.55 -44.4 72.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.17 -0.468 . . . . 74.3 111.54 176.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.02 -51.03 71.37 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.114 0.483 . . . . 72.42 111.402 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 8' ' ' GLN . 75.0 mt -59.59 -52.41 61.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.182 -0.463 . . . . 75.4 111.34 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.415 ' O ' HD11 ' A' ' 17' ' ' LEU . 71.5 mt -62.62 -43.52 98.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 116.133 -0.485 . . . . 73.14 111.751 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 29.3 t -56.04 -54.87 39.73 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.966 0.412 . . . . 75.4 111.929 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.433 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 85.5 mtt-85 -68.3 -34.35 75.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.543 -0.299 . . . . 61.41 111.326 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -59.71 -50.92 71.95 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.904 0.383 . . . . 73.24 111.332 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.489 HD22 ' HB3' ' A' ' 122' ' ' ALA . 10.8 mp -60.64 -37.94 83.14 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 122.288 -0.258 . . . . 75.53 111.488 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 14' ' ' SER . 49.8 mmm-85 -65.71 -56.71 10.64 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 111.875 0.324 . . . . 75.35 111.875 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 10.5 pt-20 -57.17 -39.13 74.71 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.989 0.424 . . . . 70.14 112.085 -178.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -68.03 -37.27 81.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.827 0.346 . . . . 75.33 111.303 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.23 -36.07 61.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.37 0.508 . . . . 70.43 112.37 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.9 p -85.8 -37.0 19.74 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.798 0.333 . . . . 65.21 111.669 -175.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.659 0 C-N-CA 121.098 -0.572 . . . . 74.34 112.487 -177.537 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.908 0 N-CA-C 114.659 0.623 . . . . 61.41 114.659 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.23 -49.73 73.32 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.535 0.569 . . . . 53.21 112.535 -175.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 89.1 m -57.25 -46.34 83.12 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.931 0.396 . . . . 71.14 111.422 -179.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.406 ' HA ' HD13 ' A' ' 12' ' ' ILE . 22.7 p -70.47 -30.98 67.94 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.532 -0.304 . . . . 74.1 111.779 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -70.76 -56.14 7.04 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.656 0.243 . . . . 70.32 111.656 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.561 ' HG3' HG21 ' A' ' 147' ' ' VAL . 51.2 pttt -60.08 -37.26 79.37 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.739 0.304 . . . . 74.41 111.181 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.65 -46.76 89.08 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.714 0.292 . . . . 50.54 111.152 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.82 -54.1 50.24 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.993 0.425 . . . . 73.24 112.039 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 11.9 pt-20 -71.34 -26.4 62.81 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.332 0.493 . . . . 72.41 112.332 -176.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.439 ' O ' HG23 ' A' ' 47' ' ' VAL . 96.3 m -72.35 -36.47 68.81 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.976 -0.452 . . . . 73.02 110.734 173.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.1 mt -54.25 -49.92 68.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.049 0.389 . . . . 73.45 112.049 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 42' ' ' GLU . 5.6 ptp180 -62.35 -42.36 99.33 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.424 0.527 . . . . 72.5 112.424 -176.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -72.69 -33.07 66.26 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.364 0.505 . . . . 73.31 112.364 -174.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 43' ' ' THR . 19.3 m -93.99 -29.64 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.911 0.386 . . . . 70.31 111.721 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -77.04 -50.57 6.75 Favored Glycine 0 CA--C 1.522 0.497 0 CA-C-N 116.229 -0.442 . . . . 72.45 113.936 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -53.02 -45.78 68.13 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 117.11 0.455 . . . . 61.04 111.406 -176.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.58 -47.44 90.03 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.105 -0.569 . . . . 75.12 112.839 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -57.77 -45.05 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.86 0.362 . . . . 64.21 110.905 176.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 26.8 mt-30 -56.32 -41.62 76.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.156 176.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -67.42 -47.7 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.382 0.512 . . . . 61.02 112.382 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -70.82 -32.83 70.02 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.283 0.563 . . . . 71.32 111.425 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -81.42 -18.37 45.64 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.247 -0.433 . . . . 75.23 112.077 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -48.84 -43.56 38.71 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.578 0.585 . . . . 75.43 112.578 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.0 t -55.2 -34.67 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.928 0.394 . . . . 74.43 111.608 178.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.77 -41.37 21.27 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.368 -0.378 . . . . 63.21 111.799 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -64.7 -40.87 96.12 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.96 0.356 . . . . 72.22 111.96 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -54.37 -36.31 63.75 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.8 0.333 . . . . 71.23 111.344 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.57 -31.7 63.87 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 116.188 -0.46 . . . . 74.53 112.834 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 59.1 mtm -89.27 -43.82 10.69 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.72 0.295 . . . . 54.12 111.019 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mp -53.07 -34.24 55.66 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.236 0.458 . . . . 73.44 112.236 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -66.09 -28.99 69.24 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.105 0.409 . . . . 74.14 112.105 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -9.24 23.15 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.121 0.486 . . . . 73.33 111.273 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -89.58 -74.87 0.46 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.31 -0.405 . . . . 75.31 111.155 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 t70 34.29 91.03 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.951 0.9 . . . . 72.35 112.249 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.48 HD12 ' N ' ' A' ' 68' ' ' ILE . 1.7 mp -64.3 104.21 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.87 -0.605 . . . . 72.33 111.888 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.73 -6.15 27.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.138 -0.483 . . . . 71.24 111.697 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.422 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.13 164.72 30.43 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.766 0.317 . . . . 64.04 111.324 173.67 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.95 -30.66 64.25 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.381 0.512 . . . . 62.23 112.381 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.65 -36.7 64.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.095 0.405 . . . . 74.41 112.095 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -62.69 -43.15 99.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.03 0.443 . . . . 71.4 110.409 176.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.3 t -58.25 -48.22 85.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 116.029 -0.532 . . . . 54.33 111.014 177.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -59.83 -33.22 71.48 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.068 0.461 . . . . 74.34 111.095 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.1 t -70.12 -34.25 72.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.387 -0.37 . . . . 61.15 111.375 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.8 mt -58.35 -32.74 68.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.679 0.276 . . . . 72.22 111.111 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.2 t -52.76 -35.48 56.45 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.014 0.435 . . . . 65.12 111.167 176.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -63.63 -46.46 85.61 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.992 0.425 . . . . 74.44 110.57 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.442 ' O ' HG22 ' A' ' 84' ' ' VAL . 60.1 t -58.22 -43.07 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.396 -0.366 . . . . 75.21 110.629 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.3 mmt -56.58 -38.79 72.48 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.855 -0.611 . . . . 72.52 111.84 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 78' ' ' SER . 55.2 mt -65.1 -36.49 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.169 0.509 . . . . 63.24 110.95 175.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.85 -27.76 60.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.246 -0.434 . . . . 72.34 112.103 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 80' ' ' VAL . 70.8 t -52.2 -34.85 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 CA-C-O 120.859 0.362 . . . . 74.01 111.304 177.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.471 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 60.6 m-85 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 112.408 0.521 . . . . 74.34 112.408 178.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.0 m95 . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 112.608 0.596 . . . . 75.1 112.608 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.55 52.98 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 121.185 -0.531 . . . . 70.14 113.309 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -70.24 -30.63 67.74 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.97 0.414 . . . . 63.15 111.264 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.36 -39.23 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 121.275 0.56 . . . . 61.35 109.622 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.02 -47.7 89.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.593 -0.731 . . . . 72.04 110.775 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.1 m -53.4 -45.81 69.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 111.873 0.323 . . . . 74.22 111.873 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.471 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 40.3 tp -61.23 -55.1 35.91 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.162 0.505 . . . . 71.03 111.909 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.0 mt -68.73 -38.82 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.262 -0.426 . . . . 63.43 111.75 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.9 p -65.1 -45.41 85.32 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.285 -0.416 . . . . 72.34 111.048 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.41 ' O ' HG22 ' A' ' 105' ' ' VAL . 25.1 t80 -56.74 -40.57 75.99 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.762 0.315 . . . . 74.45 110.781 174.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -48.34 84.71 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.037 -0.601 . . . . 62.33 112.457 174.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.453 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.74 -32.35 73.85 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.886 0.374 . . . . 71.2 111.584 177.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -64.73 -46.85 80.51 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.974 0.416 . . . . 74.42 110.688 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.45 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 61.1 t -65.74 -36.77 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 116.347 -0.388 . . . . 63.33 110.227 175.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.91 -46.94 78.28 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.126 -0.488 . . . . 61.44 111.847 177.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -54.78 -47.6 73.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.416 0.627 . . . . 74.2 110.601 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.485 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.9 t60 -63.17 -36.71 84.52 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.714 -0.675 . . . . 74.4 111.31 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 73.9 mt -63.61 -51.07 66.87 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 111.634 0.235 . . . . 74.12 111.634 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -61.25 -38.61 87.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.151 0.501 . . . . 64.44 110.507 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 93.7 m -57.84 -45.94 85.5 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.853 -0.612 . . . . 72.01 111.397 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.4 pt -88.22 22.09 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 120.752 0.31 . . . . 74.34 111.789 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.615 ' N ' HD21 ' A' ' 113' ' ' ASN . 0.7 OUTLIER 69.34 14.14 8.49 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.885 0.698 . . . . 64.43 112.885 173.106 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -100.78 37.24 1.76 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.167 0.432 . . . . 75.44 112.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.504 ' HG3' HD12 ' A' ' 118' ' ' ILE . 43.3 tt0 -60.2 -34.27 73.4 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.928 -0.482 . . . . 74.54 111.86 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.2 m -57.02 -28.93 62.92 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 122.177 -0.327 . . . . 65.32 111.843 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.7 m -73.48 -26.81 61.07 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.078 0.399 . . . . 63.44 112.078 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.504 HD12 ' HG3' ' A' ' 115' ' ' GLU . 66.2 mt -55.2 -45.92 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.772 0.656 . . . . 44.25 112.772 -177.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.81 -52.38 42.3 Favored Pre-proline 0 CA--C 1.549 0.925 0 N-CA-C 112.693 0.627 . . . . 54.52 112.693 -174.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -59.04 -27.87 86.24 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.568 1.512 . . . . 72.43 112.354 173.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.403 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.8 tt -64.73 -44.95 88.49 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.837 -0.431 . . . . 72.25 109.837 173.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.489 ' HB3' HD22 ' A' ' 17' ' ' LEU . . . -58.26 -40.54 82.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.057 0.456 . . . . 72.01 111.099 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.484 ' HG2' HD12 ' A' ' 10' ' ' LEU . 32.3 mt-10 -63.09 -36.63 84.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.088 -0.506 . . . . 74.22 111.119 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.2 m -65.27 -44.24 88.69 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.595 -0.275 . . . . 72.32 111.287 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 121' ' ' LEU . 48.7 mm -53.98 -53.13 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.131 0.491 . . . . 63.13 110.61 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -62.93 -39.84 95.81 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.669 -0.696 . . . . 74.21 111.625 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -54.35 -51.61 64.22 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.419 -0.355 . . . . 64.14 111.173 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.442 ' O ' HG21 ' A' ' 132' ' ' THR . 58.8 t -68.36 -46.27 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.296 -0.411 . . . . 60.11 111.13 177.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.554 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -51.56 -52.8 44.27 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.848 -0.615 . . . . 72.34 111.89 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.484 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 66.0 t -76.06 -32.19 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 116.194 -0.457 . . . . 74.2 111.861 -178.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -56.19 -39.38 72.34 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.042 0.386 . . . . 73.31 112.042 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.442 HG21 ' O ' ' A' ' 128' ' ' VAL . 2.5 t -104.57 -42.64 5.37 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.886 0.699 . . . . 63.3 112.886 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -102.47 26.12 8.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.681 0.623 . . . . 54.41 112.681 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 1.1 tpm_? -45.28 -53.08 8.86 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.088 0.555 . . . . 74.31 112.256 175.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . 0.509 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 3.9 m-20 -69.6 -52.19 28.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 73.34 111.779 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -58.85 -37.94 77.61 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.06 0.392 . . . . 73.44 112.06 -176.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.554 HD11 ' HG ' ' A' ' 129' ' ' LEU . 34.1 mt -54.79 -51.51 65.55 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.037 0.384 . . . . 75.4 112.037 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . 0.415 ' HB ' HH21 ' A' ' 134' ' ' ARG . 14.8 p -79.0 -36.56 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 112.441 0.534 . . . . 72.52 112.441 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 73.9 mmtt -65.52 -45.71 82.44 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.286 0.476 . . . . 64.43 112.286 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -102.32 7.05 40.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.619 0.247 . . . . 74.53 111.561 -176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 52.81 71.79 0.46 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.27 -0.423 . . . . 64.44 110.802 -176.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -49.62 -44.91 38.42 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 114.638 0.615 . . . . 74.12 114.638 -172.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -75.29 -20.02 59.35 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.447 0.536 . . . . 64.41 112.447 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -84.28 -51.06 7.29 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.897 0.379 . . . . 75.45 110.327 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -54.3 -40.31 67.69 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.961 -0.563 . . . . 38.23 113.153 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.35 -53.46 57.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 122.704 0.402 . . . . 71.43 111.894 175.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.561 HG21 ' HG3' ' A' ' 39' ' ' LYS . 80.0 t -64.22 -42.73 96.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.002 0.43 . . . . 53.25 111.988 -177.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.91 -27.81 61.23 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.911 0.337 . . . . 60.44 111.911 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -56.15 -46.35 79.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.194 0.521 . . . . 73.23 111.464 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -82.48 4.0 26.07 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.132 -0.485 . . . . 71.22 111.553 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.8 m170 56.52 54.44 7.47 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.806 0.669 . . . . 74.21 112.806 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 56.0 t . . . . . 0 CA--C 1.538 0.51 0 CA-C-O 121.255 0.55 . . . . 71.35 109.873 169.269 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 120.485 0.183 . . . . 72.15 111.446 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.18 -47.83 80.24 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.254 0.549 . . . . 71.52 111.472 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -68.05 -36.54 80.05 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.804 -0.635 . . . . 64.3 110.704 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.39 -51.55 65.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.842 -0.617 . . . . 73.53 110.523 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -65.47 -40.78 93.58 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.726 0.269 . . . . 64.31 111.726 -174.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -57.62 -52.94 63.37 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.996 0.427 . . . . 72.32 110.968 174.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.06 -40.57 94.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.001 -0.545 . . . . 71.22 110.755 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.484 HD11 ' HA ' ' A' ' 123' ' ' GLU . 42.1 tp -59.48 -44.83 92.96 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.958 -0.565 . . . . 53.24 111.518 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 42.7 tt0 -64.91 -50.34 66.89 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.748 0.309 . . . . 71.22 110.982 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.5 -48.03 80.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.884 0.373 . . . . 74.02 111.374 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.457 ' O ' HD13 ' A' ' 17' ' ' LEU . 81.0 mt -64.8 -44.67 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 116.492 -0.322 . . . . 64.4 111.43 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 38.5 t -53.96 -50.96 65.33 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.954 0.407 . . . . 74.15 111.109 177.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 61.7 mtt-85 -61.26 -49.19 78.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.225 -0.443 . . . . 74.34 111.105 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -53.95 -50.85 65.57 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.069 0.396 . . . . 64.23 112.069 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -55.77 -46.82 77.83 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.947 0.404 . . . . 74.22 111.352 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 14' ' ' SER . 35.2 mtp180 -66.02 -53.57 36.86 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 73.33 112.07 -179.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.516 ' CD ' HH21 ' A' ' 45' ' ' ARG . 15.1 pt-20 -62.59 -31.04 71.79 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 111.883 0.327 . . . . 72.34 111.883 -179.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.576 ' HG2' HE22 ' A' ' 52' ' ' GLN . 0.1 OUTLIER -75.57 -27.92 58.77 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.936 0.398 . . . . 71.03 111.241 179.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.69 -40.7 17.06 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.945 0.402 . . . . 74.34 111.708 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.2 p -87.39 -37.19 17.28 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.003 0.43 . . . . 73.31 111.955 -177.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 C-N-CA 121.263 -0.494 . . . . 36.7 112.767 -176.171 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.898 0 N-CA-C 112.443 -0.263 . . . . 73.5 112.443 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -50.63 69.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.136 0.421 . . . . 71.45 112.136 -176.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.06 -33.62 72.31 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.008 0.432 . . . . 73.52 111.176 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.9 t -68.89 -40.99 78.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.38 -0.373 . . . . 75.34 111.15 178.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -62.61 -50.32 71.72 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.42 0.629 . . . . 63.0 110.539 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -57.78 -45.4 86.04 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.165 -0.925 . . . . 71.41 111.829 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.406 ' HB1' ' HB3' ' A' ' 143' ' ' TRP . . . -59.4 -49.94 75.89 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.932 0.396 . . . . 62.43 111.383 177.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.9 tp -60.52 -52.6 64.52 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.268 -0.424 . . . . 74.12 111.862 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -61.02 -32.95 72.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.784 0.326 . . . . 50.11 111.589 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 47' ' ' VAL . 83.4 m -73.57 -41.4 62.97 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.269 -0.27 . . . . 72.33 110.836 177.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.8 mt -54.34 -45.64 72.73 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.142 0.423 . . . . 74.33 112.142 178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.516 HH21 ' CD ' ' A' ' 19' ' ' GLU . 12.5 ptp180 -65.02 -42.26 94.56 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.169 -0.332 . . . . 74.11 111.705 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -68.43 -45.29 72.98 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.921 0.341 . . . . 75.54 111.921 -176.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 43' ' ' THR . 21.0 m -86.32 -31.01 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.908 0.385 . . . . 73.12 111.709 -179.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.98 94.1 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.321 -0.466 . . . . 70.3 112.944 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.49 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 17.9 t70 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.881 0.372 . . . . 72.43 110.823 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.4 -46.42 80.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 121.307 -0.473 . . . . 52.52 112.966 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.66 -42.32 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 120.871 0.367 . . . . 63.21 111.168 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.576 HE22 ' HG2' ' A' ' 20' ' ' GLN . 79.0 mt-30 -63.25 -43.01 99.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.27 -0.423 . . . . 71.22 111.924 179.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 45.3 mtm-85 -58.2 -45.35 87.77 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.014 0.435 . . . . 70.01 111.611 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -73.87 -45.33 51.62 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.212 0.529 . . . . 72.35 111.656 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -77.27 -16.16 59.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.228 0.825 . . . . 63.44 113.228 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -46.87 -52.18 14.99 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.029 0.752 . . . . 75.45 113.029 -172.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 t -60.29 -30.62 69.58 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.022 0.379 . . . . 54.34 112.022 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.74 -50.94 11.37 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.983 0.421 . . . . 74.12 111.45 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -60.46 -42.26 95.8 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.167 0.432 . . . . 72.5 112.167 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -51.43 -39.88 58.25 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 111.955 0.354 . . . . 74.45 111.955 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.94 -34.74 72.96 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 121.289 -0.481 . . . . 64.02 113.253 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.472 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 49.1 mtm -89.77 -35.23 15.84 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.335 0.588 . . . . 63.21 110.314 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 108' ' ' HIS . 14.7 tp -56.99 -42.41 80.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.616 -0.72 . . . . 72.2 111.793 -175.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.15 -15.47 63.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.961 0.726 . . . . 73.14 112.961 -177.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 0.74 19.32 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.24 0.543 . . . . 73.13 111.225 174.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 62' ' ' MET . 94.8 mt -96.23 -69.7 0.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.036 -0.529 . . . . 73.22 110.705 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 69.63 -52.08 0.62 Allowed 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 113.649 0.981 . . . . 62.34 113.649 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.42 HD13 HD22 ' A' ' 77' ' ' LEU . 2.4 mp 64.94 99.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.483 0.713 . . . . 75.31 111.478 -174.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.09 -14.89 13.82 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.306 -0.406 . . . . 72.44 112.019 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -150.56 173.45 14.09 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.625 0.25 . . . . 75.42 110.946 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.77 -35.48 68.71 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.557 0.577 . . . . 74.21 112.557 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -54.29 -42.26 69.86 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 122.311 -0.243 . . . . 62.52 111.472 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 44.3 m-20 -63.29 -43.54 97.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.094 0.473 . . . . 53.05 110.559 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.3 t -57.99 -46.7 87.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.932 -0.576 . . . . 75.4 111.189 176.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -69.61 -28.57 66.05 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.895 0.379 . . . . 70.15 111.481 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.7 m -68.33 -32.04 71.87 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.912 0.387 . . . . 64.34 110.778 174.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.472 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.6 mt -59.73 -34.26 72.71 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.732 0.301 . . . . 75.54 110.852 174.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.1 t -52.64 -35.73 55.33 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.27 -0.423 . . . . 64.25 111.576 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -58.25 -42.3 86.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.975 0.417 . . . . 75.22 110.969 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 65.9 t -73.46 -39.25 54.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.136 0.494 . . . . 73.41 110.845 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.552 ' SD ' HD12 ' A' ' 98' ' ' LEU . 18.2 mmt -56.74 -39.92 74.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.04 -0.527 . . . . 74.23 111.532 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -60.0 -35.49 61.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.818 0.342 . . . . 55.21 111.389 175.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -65.33 -39.45 92.44 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.895 0.378 . . . . 73.13 111.328 176.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.7 t -58.59 -32.83 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 120.893 0.378 . . . . 71.31 111.404 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.461 ' CE2' HD22 ' A' ' 98' ' ' LEU . 17.0 m-30 . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 112.504 0.557 . . . . 71.41 112.504 178.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.436 ' HE3' HG13 ' A' ' 95' ' ' ILE . 33.1 m95 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 120.653 0.263 . . . . 73.45 111.457 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.97 -37.82 45.64 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.589 -0.338 . . . . 64.45 113.341 177.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 94' ' ' ARG . 22.2 mmt180 -66.31 -40.74 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 122.491 -0.417 . . . . 73.43 111.43 176.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.436 HG13 ' HE3' ' A' ' 92' ' ' TRP . 37.2 mm -61.53 -44.47 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.274 0.559 . . . . 73.51 110.062 175.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 92' ' ' TRP . 51.6 t -60.89 -41.15 87.72 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.831 -0.622 . . . . 70.24 110.963 175.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.1 m -55.44 -48.13 74.94 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.747 0.308 . . . . 74.4 111.277 178.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.552 HD12 ' SD ' ' A' ' 81' ' ' MET . 19.4 tp -62.56 -54.44 39.81 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.148 0.499 . . . . 71.12 111.501 -179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.9 mt -64.85 -38.31 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.048 -0.523 . . . . 74.2 111.497 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -63.21 -45.5 91.41 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.223 -0.444 . . . . 64.41 111.168 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.49 ' O ' HG21 ' A' ' 105' ' ' VAL . 26.5 t80 -61.05 -39.17 88.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.735 0.302 . . . . 74.34 110.568 175.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.13 -47.35 88.25 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 121.022 -0.609 . . . . 51.04 112.474 174.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.32 -35.57 81.4 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.203 0.525 . . . . 64.21 111.471 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.07 -46.73 87.8 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.023 -0.535 . . . . 70.22 110.848 177.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 101' ' ' PHE . 46.4 t -65.56 -36.43 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 116.353 -0.385 . . . . 73.11 110.613 175.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.06 -39.43 69.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.338 -0.392 . . . . 64.43 111.721 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -58.42 -44.47 89.09 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.226 0.536 . . . . 75.22 110.932 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.538 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.1 t60 -65.66 -42.62 91.16 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.128 -0.487 . . . . 74.53 110.701 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.415 HD23 ' HB ' ' A' ' 68' ' ' ILE . 97.5 mt -59.66 -50.36 74.18 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.287 -0.415 . . . . 75.22 111.086 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -56.26 -43.8 79.07 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.282 -0.417 . . . . 74.21 111.412 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.0 m -60.69 -44.04 97.02 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.166 -0.47 . . . . 64.13 112.011 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 108' ' ' HIS . 34.3 pt -89.68 16.46 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 N-CA-C 112.308 0.484 . . . . 65.12 112.308 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . 0.591 ' N ' HD21 ' A' ' 113' ' ' ASN . 0.7 OUTLIER 75.98 7.29 3.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.007 0.743 . . . . 61.54 113.007 175.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -82.72 33.69 0.43 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.551 0.34 . . . . 71.11 111.645 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.03 -30.76 64.49 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.043 0.449 . . . . 71.21 111.433 -176.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.405 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 58.7 m -69.62 -39.66 77.06 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.18 -0.325 . . . . 53.2 111.636 176.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.6 m -54.69 -26.31 32.78 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.074 0.398 . . . . 64.35 112.074 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.0 mt -53.89 -39.18 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 112.097 0.406 . . . . 70.45 112.097 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.23 -54.99 16.74 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 112.518 0.562 . . . . 74.24 112.518 -175.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . 0.405 ' HD2' ' O ' ' A' ' 116' ' ' SER . 20.9 Cg_endo -61.35 -26.85 82.15 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.769 1.646 . . . . 61.45 112.394 174.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.68 -47.44 75.44 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.776 -0.453 . . . . 74.41 109.776 174.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.5 -36.81 69.59 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.052 -0.522 . . . . 71.5 111.143 174.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.484 ' HA ' HD11 ' A' ' 10' ' ' LEU . 44.7 mt-10 -63.85 -44.94 91.64 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.353 -0.385 . . . . 73.44 111.159 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -60.77 -45.25 95.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.786 0.326 . . . . 64.23 111.456 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.3 mm -53.76 -52.22 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.213 0.53 . . . . 43.2 110.734 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -66.32 -33.39 75.62 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.928 -0.578 . . . . 75.13 111.818 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.27 -51.63 65.34 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.833 0.349 . . . . 73.14 110.684 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.423 HG21 ' HB2' ' A' ' 81' ' ' MET . 60.4 t -64.19 -36.73 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.017 0.437 . . . . 74.42 111.222 176.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.54 ' HG ' HD13 ' A' ' 137' ' ' LEU . 61.9 tp -57.51 -52.89 63.57 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.158 -0.474 . . . . 73.31 111.5 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 59.8 t -76.55 -24.66 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 116.426 -0.352 . . . . 72.41 111.658 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -44.74 -52.57 8.23 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.147 0.579 . . . . 74.42 112.513 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.04 -25.26 2.53 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.177 0.806 . . . . 72.11 113.177 -174.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 129' ' ' LEU . 1.1 mpmm? -85.27 11.39 10.17 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.647 -0.658 . . . . 73.05 111.847 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -47.39 -60.65 2.37 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 112.645 0.609 . . . . 64.52 112.645 -179.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.93 -37.81 88.88 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 64.02 111.752 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -62.58 -38.98 92.21 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.751 0.31 . . . . 71.11 111.484 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.54 HD13 ' HG ' ' A' ' 129' ' ' LEU . 72.2 mt -59.79 -49.58 77.17 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.803 0.335 . . . . 55.14 111.67 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.9 p -75.44 -40.13 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.037 0.384 . . . . 63.14 112.037 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 36.4 mmtm -68.29 -44.09 76.25 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.386 0.513 . . . . 73.33 112.386 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -88.66 5.69 41.91 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.861 0.362 . . . . 71.11 110.99 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 59.57 29.28 18.83 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.084 0.554 . . . . 75.42 112.164 177.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . 0.423 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 18.24 -86.93 0.0 OUTLIER Glycine 0 C--N 1.339 0.743 0 N-CA-C 115.917 1.127 . . . . 63.32 115.917 175.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.52 ' O ' HG22 ' A' ' 147' ' ' VAL . 14.1 m95 -75.09 -34.46 61.75 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.823 0.675 . . . . 73.45 112.823 -171.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -63.84 -52.49 59.88 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.04 0.448 . . . . 62.15 110.305 174.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.51 -35.6 92.14 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-N 115.863 -0.608 . . . . 50.13 112.718 178.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.17 -48.72 73.36 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.041 0.536 . . . . 64.42 111.998 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.52 HG22 ' O ' ' A' ' 143' ' ' TRP . 59.4 t -65.1 -45.23 94.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.317 0.488 . . . . 62.32 112.317 -176.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -73.92 -27.46 61.04 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 122.143 -0.348 . . . . 64.44 111.872 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -57.09 -50.29 73.23 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.012 0.434 . . . . 71.25 111.326 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.37 -8.93 59.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.171 -0.468 . . . . 71.44 111.22 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 7.6 t60 65.27 71.91 0.43 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.475 0.71 . . . . 72.0 112.147 176.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 67.1 t . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 116.109 -0.496 . . . . 64.14 110.757 175.696 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 112.179 0.437 . . . . 74.53 112.179 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -52.02 -45.51 64.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.406 -0.361 . . . . 74.24 111.414 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.39 -41.81 73.17 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.006 0.373 . . . . 70.05 112.006 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -66.96 -51.92 49.2 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.869 0.366 . . . . 74.15 110.694 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -59.56 -37.12 77.62 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.226 -0.443 . . . . 72.35 111.284 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -65.4 -52.1 55.75 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.992 -0.549 . . . . 74.3 111.482 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.1 m -57.32 -48.48 78.86 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.283 -0.417 . . . . 73.12 110.912 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.11 -39.84 87.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.315 -0.402 . . . . 73.14 111.3 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.0 -52.1 66.91 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 72.44 111.526 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 60.1 mt -63.65 -53.14 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 115.964 -0.562 . . . . 72.41 111.51 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.1 mt -63.0 -49.33 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.979 -0.555 . . . . 74.13 112.144 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 t -54.6 -50.82 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.85 0.357 . . . . 62.14 111.091 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 -55.09 -54.71 39.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.381 -0.372 . . . . 74.1 110.602 175.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -52.88 -44.93 67.25 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.547 0.573 . . . . 71.43 112.547 -175.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD21 ' HB3' ' A' ' 122' ' ' ALA . 9.3 mp -58.67 -51.43 69.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.643 0.259 . . . . 74.52 111.529 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -69.47 -26.31 64.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 120.75 -0.38 . . . . 72.3 111.894 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.34 -41.84 96.56 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.099 0.476 . . . . 74.33 110.652 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.584 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 25.7 mm-40 -72.26 -37.78 69.0 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.982 -0.554 . . . . 65.25 111.995 178.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.7 -43.65 88.51 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.92 0.391 . . . . 54.44 111.836 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.4 p -87.81 -37.81 16.25 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.847 0.356 . . . . 74.43 111.845 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 121.473 -0.394 . . . . 37.89 113.133 179.87 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.485 ' O ' ' HG3' ' A' ' 38' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.746 0 N-CA-C 112.175 -0.37 . . . . 55.54 112.175 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.5 -50.01 66.89 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.215 0.45 . . . . 73.25 112.215 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 86.8 m -57.08 -42.25 80.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.066 0.46 . . . . 72.43 111.394 -178.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 t -64.26 -43.87 93.51 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.354 -0.385 . . . . 75.01 111.77 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 34' ' ' GLY . 44.3 mtp-105 -65.24 -53.45 44.29 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.771 0.286 . . . . 73.23 111.771 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.509 ' HG3' HG21 ' A' ' 147' ' ' VAL . 19.6 ptmt -56.11 -37.51 69.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.103 0.478 . . . . 74.02 111.049 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.53 -47.3 70.3 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.415 -0.357 . . . . 73.51 111.213 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.427 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.2 tp -62.76 -38.54 90.97 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.23 0.456 . . . . 74.43 112.23 -177.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.11 -34.37 61.69 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.671 0.272 . . . . 54.21 111.508 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.482 HG21 HG23 ' A' ' 152' ' ' VAL . 88.3 m -75.9 -40.22 54.82 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 111.923 0.342 . . . . 53.34 111.923 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.4 mt -53.53 -35.28 60.54 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.61 0.596 . . . . 72.12 112.61 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.427 HH21 ' HG ' ' A' ' 41' ' ' LEU . 12.7 ptp180 -77.86 -42.01 34.93 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.04 -0.412 . . . . 54.31 112.097 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NH1' HG11 ' A' ' 152' ' ' VAL . 17.0 ptm180 -68.71 -32.53 72.39 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.05 0.389 . . . . 73.12 112.05 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.424 ' O ' HG23 ' A' ' 51' ' ' VAL . 22.3 m -94.14 -34.77 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 O-C-N 121.978 -0.451 . . . . 74.41 111.777 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.34 -48.8 49.73 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.439 -0.41 . . . . 72.42 113.605 -174.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.55 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 34.6 t70 -63.31 -36.11 82.59 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 122.438 -0.448 . . . . 70.03 110.778 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -49.96 70.71 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 121.147 -0.549 . . . . 64.44 112.488 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.445 ' HA ' HD22 ' A' ' 54' ' ' ASN . 81.7 t -57.91 -43.26 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.963 0.411 . . . . 61.44 111.161 175.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.406 ' O ' ' N ' ' A' ' 56' ' ' GLU . 43.0 mt-30 -54.51 -45.8 73.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.118 -0.492 . . . . 74.32 112.074 176.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 24.3 mmm180 -65.29 -50.01 67.35 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.077 0.769 . . . . 61.45 113.077 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.445 HD22 ' HA ' ' A' ' 51' ' ' VAL . 10.0 p30 -69.72 -30.57 68.22 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.741 -0.599 . . . . 61.41 110.911 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -82.13 -18.51 42.64 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.287 -0.415 . . . . 72.53 112.008 174.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 52' ' ' GLN . 37.1 tt0 -49.84 -48.15 51.21 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.325 0.491 . . . . 74.05 112.325 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -52.44 -33.73 45.45 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.949 0.404 . . . . 63.24 111.735 176.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.55 -54.29 5.8 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.295 -0.411 . . . . 62.14 111.585 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -56.59 -35.9 68.77 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.353 0.501 . . . . 75.44 112.353 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -56.44 -39.69 73.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.953 0.406 . . . . 44.11 110.91 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.405 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -61.52 -23.24 62.47 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 121.235 -0.507 . . . . 73.23 112.463 176.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 79.6 mtp -86.72 -55.4 3.88 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.706 0.288 . . . . 72.01 111.177 176.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.93 -33.15 66.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.783 0.66 . . . . 65.42 112.783 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.405 ' HE ' ' HA2' ' A' ' 61' ' ' GLY . 53.2 ptt85 -64.12 -30.84 71.88 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.941 -0.304 . . . . 74.44 111.543 178.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.04 -4.04 28.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 122.152 -0.343 . . . . 72.03 111.748 177.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.95 -71.86 0.66 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.068 0.461 . . . . 71.43 110.532 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 44.27 87.73 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.095 0.958 . . . . 72.13 112.517 -177.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.524 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.8 mp -70.19 115.41 9.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 115.881 -0.6 . . . . 74.35 111.701 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.56 -14.97 13.14 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.394 0.516 . . . . 75.41 112.394 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -148.52 172.6 14.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.227 -0.296 . . . . 70.12 111.075 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.6 -29.62 70.74 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.354 0.501 . . . . 64.11 112.354 -175.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.59 -39.57 88.59 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.769 0.319 . . . . 71.31 110.868 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.524 ' HB2' HG21 ' A' ' 68' ' ' ILE . 55.6 m-20 -59.65 -40.47 87.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.148 0.499 . . . . 73.24 110.562 175.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.4 t -58.53 -46.48 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 116.068 -0.515 . . . . 74.35 111.142 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.18 -32.43 73.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.91 0.386 . . . . 74.13 111.149 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -65.48 -37.71 87.61 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.932 0.396 . . . . 62.25 110.372 174.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.553 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -60.01 -37.85 80.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.353 -0.385 . . . . 72.44 110.964 174.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -53.48 -42.67 67.48 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.957 0.408 . . . . 65.14 110.851 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 mmm-85 -59.91 -46.67 88.61 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.189 -0.459 . . . . 64.33 110.474 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.2 t -58.97 -39.16 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.891 0.377 . . . . 43.31 111.168 177.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.8 mmt -58.67 -38.02 77.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.166 0.508 . . . . 71.23 110.857 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.72 -38.94 74.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.978 -0.555 . . . . 72.24 110.904 173.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -68.89 -29.74 68.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.162 -0.472 . . . . 64.51 111.493 178.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 82.3 t -63.84 -28.27 44.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 120.901 0.381 . . . . 72.45 111.165 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.512 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 52.4 m-85 . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 112.452 0.538 . . . . 73.34 112.452 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.9 m95 . . . . . 0 N--CA 1.478 0.929 0 N-CA-C 113.174 0.805 . . . . 72.21 113.174 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.78 -24.37 33.02 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.448 -0.406 . . . . 64.02 112.805 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.451 ' NE ' ' HA ' ' A' ' 94' ' ' ARG . 2.3 mmp_? -57.47 -44.09 84.56 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.697 0.284 . . . . 73.45 111.078 174.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.8 mm -65.61 -49.96 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.026 0.441 . . . . 74.14 110.994 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.404 HG23 ' CE1' ' A' ' 146' ' ' PHE . 61.6 t -54.29 -52.87 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.006 -0.543 . . . . 74.33 111.276 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -58.04 -42.65 85.86 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.166 -0.47 . . . . 75.11 111.662 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.512 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 29.5 tp -58.83 -54.98 40.99 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.276 0.56 . . . . 43.31 111.552 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.5 mt -69.97 -35.58 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.038 -0.528 . . . . 75.12 111.501 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.3 m -65.71 -44.73 85.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.583 -0.28 . . . . 70.43 111.185 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.461 ' O ' HG23 ' A' ' 105' ' ' VAL . 30.8 t80 -61.7 -43.43 98.87 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.676 0.274 . . . . 74.44 110.809 176.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -46.08 93.14 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 120.92 -0.657 . . . . 60.41 112.481 175.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -34.02 76.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.914 0.387 . . . . 65.11 111.519 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -65.41 -45.72 82.82 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.322 -0.399 . . . . 75.15 110.703 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 46.1 t -66.37 -36.62 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 110.085 -0.339 . . . . 54.51 110.085 175.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.74 -43.72 85.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.179 -0.464 . . . . 71.42 111.534 175.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.584 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 97.5 mttt -55.42 -46.9 76.63 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.328 0.585 . . . . 73.21 110.716 174.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.41 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.9 t60 -64.7 -34.6 78.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.13 -0.487 . . . . 71.55 111.345 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.522 HD23 ' HB ' ' A' ' 68' ' ' ILE . 80.0 mt -64.45 -49.89 69.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.496 0.189 . . . . 75.43 111.446 178.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 110' ' ' LYS . 8.3 tmtm? -57.85 -39.44 77.73 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.209 0.528 . . . . 73.22 109.802 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 m -60.52 -33.58 72.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.07 -0.514 . . . . 65.53 111.817 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.5 pt -106.28 24.97 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 112.573 0.582 . . . . 64.24 112.573 -177.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 63.52 36.77 10.94 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.735 0.642 . . . . 62.4 112.735 175.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -117.32 33.01 5.83 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.746 0.308 . . . . 73.44 111.705 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.16 -30.97 40.2 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.104 0.409 . . . . 70.01 112.104 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.9 m -67.48 -37.12 82.39 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.775 0.321 . . . . 65.04 111.054 177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.9 m -65.79 -27.2 68.1 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.093 0.405 . . . . 72.14 112.093 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.38 -39.28 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 112.476 0.547 . . . . 73.11 112.476 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -66.15 -55.54 20.49 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.604 0.594 . . . . 73.33 112.604 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.78 -26.33 81.91 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 121.736 1.624 . . . . 72.5 112.113 174.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.29 -48.22 73.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.811 -0.44 . . . . 72.44 109.811 174.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.481 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -59.14 -38.59 80.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.099 0.476 . . . . 73.21 111.226 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.39 -40.54 96.81 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 61.23 111.069 174.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.9 m -62.1 -46.66 88.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.799 0.333 . . . . 73.04 111.163 177.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 45.8 mm -54.75 -51.9 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.283 0.563 . . . . 73.21 110.97 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.2 m -66.62 -39.2 88.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.812 -0.631 . . . . 60.24 111.89 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 30.5 t70 -59.54 -53.58 56.49 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.78 -0.191 . . . . 75.15 110.798 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.414 ' O ' HG22 ' A' ' 132' ' ' THR . 62.3 t -61.55 -43.43 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 120.908 0.385 . . . . 65.23 111.044 178.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.566 ' HG ' HD13 ' A' ' 137' ' ' LEU . 35.6 tp -49.6 -52.48 30.05 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.922 -0.581 . . . . 72.22 111.53 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.16 -34.51 26.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.332 0.586 . . . . 62.51 111.387 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.583 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 50.7 ttt180 -58.4 -33.36 69.56 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.831 0.852 . . . . 72.54 112.872 -174.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.614 HG21 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -116.66 -14.36 10.83 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.852 1.056 . . . . 64.11 113.852 -177.683 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.833 ' HZ2' ' HB3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.33 48.9 0.9 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.537 0.94 . . . . 71.25 113.537 174.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -51.69 -60.53 3.06 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.319 0.489 . . . . 74.11 112.319 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.82 -47.23 85.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.356 -0.384 . . . . 64.42 111.961 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . 0.548 ' HB2' ' HB2' ' A' ' 133' ' ' LYS . 95.3 m95 -53.32 -38.87 63.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.873 0.323 . . . . 74.33 111.873 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.566 HD13 ' HG ' ' A' ' 129' ' ' LEU . 46.0 mt -54.05 -51.13 65.03 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.228 -0.442 . . . . 74.35 112.167 177.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.68 -43.61 25.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 O-C-N 121.94 -0.475 . . . . 63.12 112.244 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -54.21 -52.63 60.65 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.174 0.512 . . . . 70.02 111.631 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -93.77 5.12 52.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.488 . . . . 72.44 111.43 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 59.31 38.76 23.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.38 -0.373 . . . . 73.31 111.945 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -27.04 -49.33 0.06 OUTLIER Glycine 0 N--CA 1.471 1.022 0 N-CA-C 116.238 1.255 . . . . 54.35 116.238 -173.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.41 ' O ' HG22 ' A' ' 147' ' ' VAL . 13.0 m95 -67.45 -51.39 52.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 117.733 0.766 . . . . 72.32 111.716 -178.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.82 -29.07 68.9 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.905 0.383 . . . . 73.44 111.11 174.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.54 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -69.43 -37.88 79.58 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.944 -0.463 . . . . 72.41 111.944 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . 0.404 ' CE1' HG23 ' A' ' 96' ' ' VAL . 19.1 t80 -60.45 -41.4 94.0 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.175 0.512 . . . . 71.33 110.88 173.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.509 HG21 ' HG3' ' A' ' 39' ' ' LYS . 58.4 t -70.73 -38.21 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 116.033 -0.53 . . . . 74.42 112.314 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.54 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.4 pt-20 -74.0 -40.07 63.2 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 122.274 -0.266 . . . . 71.54 111.629 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -58.24 -48.34 80.71 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.978 0.418 . . . . 73.15 111.463 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -80.75 -9.13 59.83 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.439 -0.346 . . . . 73.3 111.148 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 67.5 t60 57.93 63.02 1.89 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.458 0.647 . . . . 75.21 112.19 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.482 HG23 HG21 ' A' ' 43' ' ' THR . 87.4 t . . . . . 0 N--CA 1.467 0.416 0 CA-C-N 115.979 -0.555 . . . . 63.52 110.21 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 120.675 0.274 . . . . 75.03 111.547 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.6 -41.0 98.36 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.074 0.398 . . . . 74.12 112.074 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 137' ' ' LEU . 63.4 tp -60.26 -41.58 93.54 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.702 0.287 . . . . 74.34 110.615 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -57.06 -49.04 77.08 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.82 174.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -63.73 -43.49 96.34 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.884 0.373 . . . . 73.34 111.714 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.445 ' O ' HG13 ' A' ' 12' ' ' ILE . 54.3 tt0 -62.66 -52.24 64.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.159 0.504 . . . . 71.2 111.308 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.1 p -61.61 -44.39 97.08 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.007 -0.542 . . . . 75.34 111.09 177.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.471 ' HA ' ' HG1' ' A' ' 126' ' ' THR . 58.3 tp -53.61 -45.04 69.92 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.232 -0.44 . . . . 73.34 111.44 175.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.21 -51.43 69.02 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.715 0.293 . . . . 64.53 111.571 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 8' ' ' GLN . 62.9 mt -55.8 -51.89 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.117 0.484 . . . . 75.45 111.386 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 74.8 mt -66.72 -49.76 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.996 -0.547 . . . . 71.11 112.195 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 87.9 p -55.5 -47.84 75.56 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.88 0.371 . . . . 75.41 111.601 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -62.55 -41.94 99.22 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.406 -0.361 . . . . 73.05 111.615 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.408 ' OH ' ' HA3' ' A' ' 48' ' ' GLY . 56.0 t80 -61.07 -46.49 90.47 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.904 0.383 . . . . 75.04 111.043 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -63.52 -34.56 78.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.47 -0.332 . . . . 64.52 111.601 177.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.486 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -62.95 -54.06 44.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.62 0.248 . . . . 65.44 111.477 176.552 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.0 -35.33 79.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.097 0.475 . . . . 74.01 111.624 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -72.37 -28.07 62.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.839 0.352 . . . . 73.04 111.724 175.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.582 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -72.89 -39.16 66.61 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 121.224 0.535 . . . . 74.2 110.928 175.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.5 p -87.62 -20.12 26.81 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.92 -0.582 . . . . 62.44 111.849 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.805 0 C-N-CA 121.654 -0.308 . . . . 39.22 113.779 175.692 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.746 0 CA-C-O 120.703 0.057 . . . . 60.35 113.167 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.1 70.21 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.996 0.739 . . . . 65.42 112.996 -173.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.1 m -54.7 -54.18 45.24 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 120.955 0.407 . . . . 73.54 111.856 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.2 m -71.85 -31.48 66.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.461 -0.336 . . . . 72.43 111.867 -177.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.3 tpt85 -64.02 -48.02 77.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 120.655 0.264 . . . . 65.31 111.438 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' HG3' HG21 ' A' ' 147' ' ' VAL . 6.1 ptmm? -76.2 -27.78 57.01 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.71 0.291 . . . . 65.2 111.41 178.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.57 -52.97 48.34 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.837 0.351 . . . . 61.22 110.948 174.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.5 tp -61.39 -38.27 86.43 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.176 0.512 . . . . 74.34 110.816 176.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.27 -40.52 90.67 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.92 -0.582 . . . . 71.21 110.827 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.54 HG21 HG21 ' A' ' 152' ' ' VAL . 93.6 m -69.64 -45.54 68.24 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.106 -0.497 . . . . 74.15 111.202 176.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.2 mt -54.28 -46.34 72.68 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.504 0.557 . . . . 72.21 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 45' ' ' ARG . 6.5 ptp180 -65.58 -34.11 77.48 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.152 -0.342 . . . . 73.12 111.447 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -73.07 -44.84 60.02 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 111.941 0.349 . . . . 74.41 111.941 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.412 ' O ' HG23 ' A' ' 51' ' ' VAL . 33.5 m -79.72 -34.12 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.793 0.33 . . . . 74.13 111.329 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.408 ' HA3' ' OH ' ' A' ' 16' ' ' TYR . . . -66.12 -39.35 94.59 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 121.459 -0.401 . . . . 53.3 112.859 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.99 -45.63 61.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.974 0.416 . . . . 72.35 111.417 174.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.44 -51.16 10.09 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 120.985 -0.626 . . . . 61.12 112.987 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.5 t -57.44 -53.48 43.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.372 0.508 . . . . 50.11 112.372 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -59.88 -44.81 93.99 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.204 0.446 . . . . 64.35 112.204 -177.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -65.44 -33.72 76.61 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.098 0.777 . . . . 74.11 113.098 -175.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -84.6 -34.14 23.21 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.336 -0.853 . . . . 74.42 111.062 176.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -75.47 -18.18 59.93 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.213 0.449 . . . . 72.31 112.213 177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.86 -55.19 10.37 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.644 0.609 . . . . 73.44 112.644 -174.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.8 t -58.93 -35.25 72.79 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.141 0.422 . . . . 62.22 112.141 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.72 -53.27 23.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.828 0.346 . . . . 74.11 111.649 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -63.92 -33.01 74.74 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.532 -0.303 . . . . 72.32 111.736 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.512 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 41.4 mm-40 -47.76 -46.79 30.56 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.554 0.216 . . . . 63.41 111.297 176.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.3 -41.07 61.64 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 121.233 -0.508 . . . . 74.11 112.913 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.445 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.9 mtp -70.51 -40.88 73.25 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.037 0.446 . . . . 75.31 111.081 178.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -62.2 -26.89 68.61 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.494 -0.321 . . . . 74.44 111.799 176.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 33.4 mtm180 -60.77 -26.57 67.33 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.233 0.457 . . . . 73.43 112.233 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 62' ' ' MET . 56.3 pttt -94.71 -8.98 36.19 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.863 0.363 . . . . 52.23 111.209 176.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.496 HD11 HD21 ' A' ' 77' ' ' LEU . 93.8 mt -105.92 -84.78 0.5 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.581 0.585 . . . . 71.22 112.581 -173.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.75 -22.41 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.529 0.937 . . . . 73.25 113.529 -173.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.457 ' H ' ' C ' ' A' ' 66' ' ' LEU . 2.4 mp 59.34 95.65 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.659 0.783 . . . . 75.32 112.456 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.79 -8.65 18.62 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.604 . . . . 74.34 111.443 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.433 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.35 -179.71 7.61 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.377 -0.374 . . . . 71.22 110.674 175.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 34.8 tt0 -59.74 -37.26 78.47 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.837 0.31 . . . . 65.44 111.837 -178.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -54.28 -36.13 63.32 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 111.863 0.32 . . . . 72.24 111.863 -174.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -61.75 -44.39 97.0 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.317 0.58 . . . . 73.54 110.618 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.03 -36.97 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 121.265 0.555 . . . . 75.3 110.828 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.6 mmmt -65.13 -31.34 72.49 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.025 0.44 . . . . 71.32 110.577 176.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -67.78 -40.39 83.97 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.059 0.456 . . . . 74.53 110.609 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 81' ' ' MET . 96.7 mt -55.91 -40.3 72.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.133 -0.485 . . . . 71.22 110.93 175.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.8 t -54.86 -44.5 74.06 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.018 0.437 . . . . 64.5 111.069 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -57.92 -44.23 86.75 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.147 -0.479 . . . . 74.42 110.803 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.422 ' O ' HG23 ' A' ' 84' ' ' VAL . 57.6 t -61.08 -41.81 90.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.207 -0.452 . . . . 71.14 111.131 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.4 mmt -57.7 -43.89 85.47 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.07 0.462 . . . . 62.12 111.241 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 68.6 mt -56.13 -41.27 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.232 0.539 . . . . 73.23 110.87 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.76 -26.35 59.71 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.447 0.536 . . . . 72.21 112.447 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 80' ' ' VAL . 78.8 t -55.91 -33.09 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.135 0.493 . . . . 74.54 111.178 174.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.494 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.3 m-85 . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 112.485 0.55 . . . . 72.31 112.485 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.1 m95 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.625 0.25 . . . . 73.33 111.413 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.46 -35.79 51.96 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 121.428 -0.415 . . . . 63.1 113.225 177.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -54.82 -40.41 69.53 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 111.998 0.37 . . . . 72.24 111.998 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.8 mm -66.64 -46.47 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 120.905 0.383 . . . . 74.32 110.839 177.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.7 t -57.93 -43.33 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 120.978 0.418 . . . . 74.14 110.838 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.1 m -59.82 -42.25 93.09 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.168 -0.469 . . . . 65.21 111.239 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.506 HD11 ' SD ' ' A' ' 81' ' ' MET . 29.1 tp -59.54 -54.67 43.82 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.258 0.552 . . . . 63.43 111.67 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.4 mt -69.7 -39.99 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 115.991 -0.549 . . . . 73.41 111.873 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.2 p -63.45 -45.76 89.38 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.593 -0.276 . . . . 75.34 111.743 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.66 -43.27 93.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.795 0.331 . . . . 72.14 111.018 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.43 -45.47 92.93 Favored Glycine 0 CA--C 1.529 0.906 0 C-N-CA 120.904 -0.665 . . . . 61.4 112.314 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.34 -35.32 80.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.113 0.482 . . . . 73.23 111.647 177.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -64.75 -40.82 95.93 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.151 -0.477 . . . . 73.14 111.242 178.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.457 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 59.9 t -71.9 -38.44 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 120.838 0.352 . . . . 72.12 110.673 176.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.43 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.68 0.622 . . . . 73.13 112.68 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.619 ' HB3' ' HZ2' ' A' ' 107' ' ' LYS . 0.9 OUTLIER -61.27 -38.89 88.38 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.849 0.357 . . . . 71.51 111.494 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.43 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.4 t60 -65.59 -36.71 84.54 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.746 0.308 . . . . 75.22 110.703 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 81.4 mt -62.95 -50.44 70.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.489 -0.323 . . . . 60.12 111.859 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.836 0.35 . . . . 51.03 111.075 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.2 m -57.48 -37.82 73.53 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.403 -0.362 . . . . 63.32 111.737 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.6 pt -97.56 21.66 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 120.913 0.387 . . . . 75.34 111.646 177.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 68.75 6.81 5.75 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.637 0.977 . . . . 73.11 113.637 174.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -82.87 40.92 0.71 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.281 0.474 . . . . 63.12 112.281 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.0 -33.01 72.58 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.859 -0.526 . . . . 74.31 111.27 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 38.8 m -56.74 -28.09 60.51 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.519 -0.31 . . . . 73.31 111.435 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.9 m -79.24 -27.04 42.4 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.769 0.318 . . . . 74.43 111.834 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.5 mt -59.73 -41.39 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.482 0.549 . . . . 74.32 112.482 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -62.2 -56.42 31.26 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 112.402 0.519 . . . . 65.4 112.402 -178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.19 -30.23 90.82 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.846 1.697 . . . . 62.33 112.419 176.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -64.14 -50.18 69.22 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 109.66 -0.496 . . . . 64.02 109.66 174.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.75 -41.54 77.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.008 -0.542 . . . . 74.34 111.381 177.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -61.91 -46.19 90.46 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.448 -0.342 . . . . 73.32 111.009 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.9 m -56.4 -38.34 71.39 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.206 0.447 . . . . 62.14 112.206 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.402 HG22 ' HG ' ' A' ' 98' ' ' LEU . 41.4 mm -57.2 -53.88 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.204 0.526 . . . . 72.41 111.014 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' THR . . . . . 0.471 ' HG1' ' HA ' ' A' ' 10' ' ' LEU . 38.3 m -71.41 -33.76 69.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.935 -0.575 . . . . 71.54 111.453 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -59.82 -51.58 69.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.165 -0.471 . . . . 73.45 111.163 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.574 ' O ' HG23 ' A' ' 132' ' ' THR . 63.1 t -64.29 -48.89 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 120.87 0.367 . . . . 64.45 110.633 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.577 ' HG ' HD11 ' A' ' 137' ' ' LEU . 59.8 tp -49.21 -52.65 25.58 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.878 -0.601 . . . . 73.34 111.817 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.555 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -66.28 -52.24 49.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.231 -0.441 . . . . 55.01 111.519 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 131' ' ' ARG . 42.3 ttm105 -48.18 -46.08 34.42 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.89 0.7 . . . . 71.13 112.89 -176.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.574 HG23 ' O ' ' A' ' 128' ' ' VAL . 3.8 t -99.93 -28.76 12.93 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.082 1.141 . . . . 73.53 114.082 -173.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.505 ' HD2' HG22 ' A' ' 132' ' ' THR . 1.4 mptp? -131.82 31.05 4.27 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.529 0.937 . . . . 75.04 113.529 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.555 ' HD3' HG13 ' A' ' 130' ' ' VAL . 37.3 tpt85 -54.5 -45.96 73.37 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.018 0.437 . . . . 73.43 111.754 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.11 -50.85 72.47 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.049 -0.523 . . . . 62.35 111.703 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -57.79 -37.09 73.1 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 111.956 0.354 . . . . 74.21 111.956 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.577 HD11 ' HG ' ' A' ' 129' ' ' LEU . 77.6 mt -57.16 -48.56 78.4 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.11 0.411 . . . . 74.32 112.11 177.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.19 -36.83 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 122.156 -0.34 . . . . 63.41 111.753 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.45 -53.36 59.06 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.009 0.433 . . . . 75.1 111.865 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -93.89 7.01 46.59 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.118 0.414 . . . . 73.21 112.118 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 52.97 54.51 10.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.017 0.437 . . . . 72.53 110.509 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -30.94 -56.69 0.27 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 115.964 1.146 . . . . 71.21 115.964 -170.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.483 ' O ' HG22 ' A' ' 147' ' ' VAL . 18.6 m95 -69.87 -44.19 70.31 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 117.388 0.594 . . . . 74.51 112.548 -173.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.65 -51.2 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.927 0.394 . . . . 74.43 111.14 174.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . 0.424 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.14 -38.37 85.52 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 116.059 -0.519 . . . . 61.14 112.803 178.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -57.83 -53.79 54.28 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.037 0.446 . . . . 71.32 111.527 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 143' ' ' TRP . 29.8 t -66.02 -42.5 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.135 0.42 . . . . 72.44 112.135 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.424 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.3 pt-20 -70.43 -34.15 72.15 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 122.168 -0.332 . . . . 63.2 111.544 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -62.2 -47.48 84.25 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.994 0.426 . . . . 73.34 110.816 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -79.78 -4.63 52.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.304 -0.407 . . . . 74.24 111.391 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.7 p80 43.02 39.75 1.94 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.109 0.963 . . . . 71.22 112.964 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.54 HG21 HG21 ' A' ' 43' ' ' THR . 56.1 t . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 116.581 -0.281 . . . . 75.54 111.39 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 CA--C 1.547 0.836 0 CA-C-O 120.311 0.101 . . . . 73.21 111.025 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.53 -46.18 77.1 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.016 0.436 . . . . 73.05 111.26 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.55 -34.11 70.67 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.109 -0.496 . . . . 63.14 110.773 177.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -67.23 -43.4 82.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.963 -0.562 . . . . 75.31 110.536 177.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -67.85 -43.63 79.01 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.189 0.44 . . . . 74.32 112.189 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -58.0 -50.85 71.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.208 0.528 . . . . 64.35 110.693 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.3 p -64.04 -51.89 62.02 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.907 -0.588 . . . . 63.25 111.544 178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 61.7 tp -51.98 -42.73 63.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 111.857 0.317 . . . . 74.43 111.857 177.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -57.78 -52.83 63.87 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.124 0.488 . . . . 74.33 111.044 177.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.51 -48.38 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.851 -0.613 . . . . 71.44 111.897 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.452 HG21 HG22 ' A' ' 99' ' ' ILE . 75.3 mt -64.09 -52.52 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.359 -0.382 . . . . 65.34 111.968 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.7 p -52.78 -47.72 67.33 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.807 0.337 . . . . 73.01 111.637 -178.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 74.6 mtt180 -57.52 -51.26 70.17 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.648 -0.251 . . . . 63.13 110.8 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -53.22 -39.27 63.63 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.02 0.378 . . . . 72.43 112.02 -177.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.517 HD21 ' HB3' ' A' ' 122' ' ' ALA . 10.9 mp -62.93 -46.14 89.17 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.57 0.211 . . . . 73.11 111.57 176.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.67 -34.69 78.88 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.118 -0.364 . . . . 70.31 111.356 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.0 mm-40 -56.63 -51.76 67.47 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.306 0.574 . . . . 73.31 111.114 176.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -77.97 -23.42 48.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.962 -0.563 . . . . 71.33 112.495 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.01 -48.27 21.66 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.978 0.418 . . . . 64.21 111.59 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.422 HG21 ' HE3' ' A' ' 110' ' ' LYS . 32.8 p -92.07 -38.77 12.01 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.095 0.405 . . . . 71.31 112.095 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.842 0 C-N-CA 121.217 -0.516 . . . . 65.15 112.696 -175.076 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.604 0 CA-C-O 120.562 -0.021 . . . . 36.97 113.122 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.77 -50.11 71.33 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 111.837 0.31 . . . . 53.1 111.837 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -61.68 -53.25 58.59 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.015 0.376 . . . . 65.24 112.015 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.2 m -60.83 -33.06 72.46 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.842 0.353 . . . . 64.5 111.635 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 -68.03 -56.53 8.57 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.841 0.353 . . . . 73.44 111.408 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HG3' HG21 ' A' ' 147' ' ' VAL . 16.9 ptmt -64.41 -32.05 73.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.403 -0.362 . . . . 72.03 111.518 -177.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -47.5 78.9 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.842 0.354 . . . . 70.43 111.089 175.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.49 ' HG ' HH21 ' A' ' 45' ' ' ARG . 51.7 tp -64.67 -38.0 89.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.286 0.476 . . . . 73.02 112.286 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.506 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 12.1 pt-20 -75.79 -34.67 60.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.002 -0.436 . . . . 73.03 111.415 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.532 ' OG1' HG23 ' A' ' 152' ' ' VAL . 56.8 m -67.47 -38.67 84.75 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.083 -0.386 . . . . 73.4 111.138 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.64 -43.87 69.12 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.925 0.342 . . . . 74.41 111.925 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.49 HH21 ' HG ' ' A' ' 41' ' ' LEU . 16.0 ptp180 -78.72 -36.65 43.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.828 0.346 . . . . 74.22 111.176 177.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.476 ' NH1' HG11 ' A' ' 152' ' ' VAL . 32.4 ttt180 -57.12 -43.13 82.03 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.169 0.587 . . . . 74.42 112.163 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 43' ' ' THR . 19.3 m -101.59 -33.96 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.855 0.36 . . . . 63.52 111.642 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.453 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -61.96 -35.9 92.07 Favored Glycine 0 C--N 1.333 0.375 0 CA-C-N 116.317 -0.401 . . . . 75.11 113.614 -177.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 28.4 t70 -54.68 -55.49 29.13 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.064 0.459 . . . . 75.3 110.981 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.05 99.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.13 -0.557 . . . . 53.41 112.752 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 47' ' ' VAL . 65.6 t -57.28 -46.98 85.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 O-C-N 122.659 -0.318 . . . . 70.22 111.504 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.9 mt-30 -55.86 -46.66 78.18 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.655 0.264 . . . . 44.15 111.158 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 35.3 mtp85 -60.92 -41.12 95.55 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.179 0.437 . . . . 65.22 112.179 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -71.48 -37.57 71.29 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.242 0.544 . . . . 74.02 111.496 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -83.83 -19.05 35.62 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.646 0.61 . . . . 64.31 112.646 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 38.9 tt0 -49.17 -55.3 12.85 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.298 0.481 . . . . 64.32 112.298 -174.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -52.17 -34.78 46.5 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.904 0.383 . . . . 64.52 112.0 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.47 -42.39 59.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.87 0.367 . . . . 72.43 111.719 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -69.87 -34.36 73.48 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.12 0.415 . . . . 73.32 112.12 -178.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 84.0 mm-40 -51.04 -38.24 50.24 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.084 0.469 . . . . 71.14 111.322 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.491 ' HA2' ' NH1' ' A' ' 64' ' ' ARG . . . -58.67 -33.0 70.62 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.01 -0.541 . . . . 75.42 113.861 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.477 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 71.0 mtm -90.05 -45.31 9.24 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.293 -0.533 . . . . 75.32 111.717 178.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.22 -29.52 61.11 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.517 0.562 . . . . 65.02 112.517 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.491 ' NH1' ' HA2' ' A' ' 61' ' ' GLY . 18.3 ptt-85 -65.24 -19.0 65.76 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.748 0.309 . . . . 63.12 111.737 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.0 3.46 8.69 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.881 0.697 . . . . 64.25 112.881 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 62' ' ' MET . 82.5 mt -90.25 -77.32 0.4 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.904 0.335 . . . . 73.02 111.904 178.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 52.52 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.654 0.74 . . . . 73.43 112.49 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.507 HG21 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -77.86 99.12 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 115.62 -0.718 . . . . 73.52 110.532 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.441 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.86 -9.87 16.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.961 -0.563 . . . . 72.55 112.194 -176.992 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.441 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -157.46 173.75 16.43 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.845 0.355 . . . . 61.5 111.431 173.266 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -56.53 -39.67 73.77 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.16 0.8 . . . . 64.32 113.16 -171.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -54.34 -34.46 61.1 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.739 0.304 . . . . 52.03 111.344 -177.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.507 ' HB2' HG21 ' A' ' 68' ' ' ILE . 49.3 m-20 -63.39 -46.25 87.31 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.025 0.441 . . . . 60.11 110.849 176.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 80.3 t -58.28 -46.07 89.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.378 0.608 . . . . 73.22 110.512 176.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.578 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 6.6 mtpm? -64.16 -28.0 69.46 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.765 -0.652 . . . . 75.5 110.915 177.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 55.4 m -73.03 -36.36 66.95 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.897 0.379 . . . . 72.44 110.789 174.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.453 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -61.72 -37.09 82.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.482 -0.326 . . . . 74.43 110.896 175.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 t -52.78 -39.52 62.35 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.188 0.518 . . . . 71.53 111.135 176.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -62.6 -38.78 91.53 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.926 -0.579 . . . . 72.42 110.896 177.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.71 -42.89 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.876 0.369 . . . . 73.33 110.74 175.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 20.7 mmt -54.96 -40.98 70.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.017 -0.538 . . . . 74.34 111.256 178.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.2 -43.05 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.091 -0.504 . . . . 72.11 111.013 175.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -67.06 -28.77 68.47 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.087 -0.506 . . . . 71.34 112.064 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 91.8 t -55.46 -35.05 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.112 0.482 . . . . 55.42 111.366 177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.511 ' HA ' ' NH2' ' A' ' 94' ' ' ARG . 73.8 m-85 . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 112.128 0.418 . . . . 73.55 112.128 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.458 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 94.0 m95 . . . . . 0 N--CA 1.473 0.702 0 N-CA-C 111.875 0.324 . . . . 73.32 111.875 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.74 -24.59 49.12 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.276 -0.488 . . . . 73.0 112.999 174.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.511 ' NH2' ' HA ' ' A' ' 85' ' ' PHE . 73.1 mtp180 -66.65 -43.04 85.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.938 0.399 . . . . 74.15 110.452 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.72 -43.44 95.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.217 0.532 . . . . 74.41 110.297 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.1 t -60.54 -42.71 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.929 -0.578 . . . . 54.32 110.959 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.9 m -60.87 -42.56 98.13 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.93 0.395 . . . . 73.54 111.162 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.482 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 27.0 tp -59.66 -54.64 44.1 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.263 0.554 . . . . 73.35 111.515 177.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . 0.452 HG22 HG21 ' A' ' 13' ' ' ILE . 59.4 mt -69.1 -37.84 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-N 116.073 -0.512 . . . . 72.05 111.746 -177.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.5 p -65.6 -40.37 92.6 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.33 -0.231 . . . . 72.0 111.311 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -62.22 -42.3 99.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.666 0.27 . . . . 65.34 110.506 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.76 -47.2 87.44 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.914 -0.66 . . . . 44.55 112.219 174.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 107' ' ' LYS . . . -66.42 -34.65 78.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.946 0.403 . . . . 50.22 111.582 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -64.87 -45.51 85.7 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.044 0.449 . . . . 73.54 110.679 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.75 -37.49 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 116.335 -0.393 . . . . 70.25 110.584 175.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.74 -40.85 66.49 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.793 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 93.7 mttt -57.28 -49.36 76.34 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.111 0.482 . . . . 75.2 110.651 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . 0.429 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.5 t60 -64.68 -33.2 75.39 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.103 -0.499 . . . . 72.43 110.996 178.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.502 HD23 ' HB ' ' A' ' 68' ' ' ILE . 76.6 mt -62.95 -50.78 69.47 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.619 -0.264 . . . . 73.34 111.44 177.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.422 ' HE3' HG21 ' A' ' 22' ' ' THR . 61.6 tttm -65.39 -27.41 68.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.984 0.421 . . . . 70.41 110.609 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.1 m -65.66 -31.67 72.82 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.115 -0.493 . . . . 73.44 111.382 175.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.8 pt -108.77 36.34 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-O 120.777 0.322 . . . . 73.3 111.455 177.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 p30 47.7 20.41 0.2 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.225 1.194 . . . . 51.4 114.225 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.17 35.71 0.81 Allowed 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.203 0.525 . . . . 74.53 110.879 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -56.69 -39.24 73.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.008 -0.542 . . . . 73.34 112.105 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 79.1 p -65.37 -27.63 68.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.491 -0.322 . . . . 65.02 111.643 178.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.5 m -68.57 -26.4 65.38 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.545 0.338 . . . . 74.1 111.81 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.23 -40.78 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 N-CA-C 112.62 0.6 . . . . 60.32 112.62 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.95 -52.52 23.87 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 112.852 0.686 . . . . 51.42 112.852 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.14 -27.14 84.27 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.88 1.72 . . . . 64.45 112.159 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.65 -46.36 82.86 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 109.831 -0.433 . . . . 64.41 109.831 172.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.517 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -58.07 -39.4 78.43 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.02 0.438 . . . . 61.15 111.132 174.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.62 -43.17 97.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.405 -0.361 . . . . 64.0 110.943 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.2 m -58.71 -47.47 84.44 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.886 0.374 . . . . 72.34 111.015 177.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.8 mm -52.7 -52.51 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.44 0.638 . . . . 63.41 111.087 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.8 m -67.04 -38.41 85.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.421 -0.809 . . . . 70.35 112.261 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.07 -51.15 65.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.674 0.273 . . . . 65.33 110.889 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 67.0 t -60.4 -33.85 55.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.371 0.605 . . . . 65.42 110.944 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.533 ' HG ' HD13 ' A' ' 137' ' ' LEU . 38.8 tp -66.12 -54.04 30.52 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.999 -0.546 . . . . 74.53 111.917 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 61.5 t -76.49 -29.63 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 111.941 0.349 . . . . 65.2 111.941 -176.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.56 -49.94 66.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.989 0.423 . . . . 63.21 112.122 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.524 ' OG1' ' HD3' ' A' ' 133' ' ' LYS . 10.5 p -109.99 -39.23 5.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 75.32 112.402 -175.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.524 ' HD3' ' OG1' ' A' ' 132' ' ' THR . 2.7 mppt? -82.46 10.79 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.294 0.479 . . . . 72.34 112.294 -177.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 20.9 tpt180 -45.71 -61.24 1.79 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.849 0.685 . . . . 74.43 112.849 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.05 -49.06 79.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.071 0.462 . . . . 64.34 111.363 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -60.68 -36.93 79.97 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.156 -0.475 . . . . 73.2 111.996 -177.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.533 HD13 ' HG ' ' A' ' 129' ' ' LEU . 29.7 mt -59.35 -54.48 46.26 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.685 0.254 . . . . 73.22 111.685 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.8 p -71.11 -38.44 71.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 112.027 0.38 . . . . 54.15 112.027 -178.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -63.12 -46.02 89.27 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.122 0.416 . . . . 72.12 112.122 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -94.65 6.23 49.48 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.995 0.426 . . . . 73.43 111.317 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 62.05 26.63 16.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.92 -0.582 . . . . 63.45 112.281 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . 0.458 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 25.83 -83.09 0.0 OUTLIER Glycine 0 N--CA 1.468 0.787 0 N-CA-C 115.903 1.121 . . . . 73.32 115.903 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -75.34 -38.17 60.31 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.124 0.416 . . . . 62.14 112.124 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 20.0 m-20 -64.69 -48.08 76.01 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.922 -0.399 . . . . 75.53 109.922 173.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.53 93.19 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.148 -0.549 . . . . 64.44 112.492 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.05 -49.34 74.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.921 0.488 . . . . 71.43 111.164 174.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.51 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.5 t -68.89 -35.96 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 116.351 -0.386 . . . . 62.43 111.281 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 46.0 mt-10 -57.5 -47.54 81.65 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.088 0.47 . . . . 54.44 111.154 176.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -60.04 -48.96 79.53 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.077 -0.511 . . . . 75.44 111.728 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -83.94 -3.63 58.1 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.157 0.428 . . . . 74.22 112.157 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.4 p80 44.59 86.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.92 1.082 . . . . 72.14 113.92 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.532 HG23 ' OG1' ' A' ' 43' ' ' THR . 81.8 t . . . . . 0 N--CA 1.472 0.628 0 CA-C-O 121.219 0.533 . . . . 74.11 110.691 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 113.194 0.813 . . . . 65.31 113.194 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -49.82 -47.57 51.33 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.334 -0.848 . . . . 74.31 111.61 175.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.424 HD23 ' HB2' ' A' ' 137' ' ' LEU . 66.3 tp -69.54 -36.54 76.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.815 -0.63 . . . . 74.34 111.413 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -68.12 -44.56 75.85 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.236 -0.438 . . . . 73.22 111.297 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.603 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 24.8 mmm180 -71.94 -32.77 67.66 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.224 0.453 . . . . 74.23 112.224 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -64.16 -51.85 61.83 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.146 0.498 . . . . 73.45 111.07 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 p -61.68 -54.51 41.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.093 -0.503 . . . . 73.41 111.673 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.498 HD22 HH11 ' A' ' 7' ' ' ARG . 50.6 tp -54.35 -37.96 65.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.444 -0.344 . . . . 64.42 111.832 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.603 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 1.9 tm-20 -60.28 -53.43 57.79 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.263 0.554 . . . . 73.21 111.273 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.44 HD11 ' HB1' ' A' ' 40' ' ' ALA . 65.0 mt -63.5 -47.76 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.811 -0.631 . . . . 75.52 111.342 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.451 ' O ' HD11 ' A' ' 17' ' ' LEU . 74.6 mt -61.64 -51.42 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.04 -0.527 . . . . 75.5 111.623 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -52.13 -50.05 62.47 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.05 0.452 . . . . 64.42 111.733 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.552 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 66.7 mtt-85 -62.78 -42.02 99.51 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.859 -0.337 . . . . 70.23 111.657 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -57.6 -44.08 85.16 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.38 . . . . 73.55 111.613 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 122' ' ' ALA . 10.2 mp -56.84 -44.38 82.04 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.965 0.412 . . . . 72.22 110.571 174.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -66.52 -32.72 74.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.319 -0.4 . . . . 75.35 111.996 175.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 8.6 mm-40 -62.35 -41.99 99.04 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.354 0.597 . . . . 74.23 110.645 177.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -78.46 -30.67 47.53 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.636 -0.711 . . . . 73.5 112.207 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.32 -38.69 71.7 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.937 0.398 . . . . 74.43 111.739 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 63.6 p -87.05 -36.21 18.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.766 0.317 . . . . 74.22 111.715 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.638 0 C-N-CA 121.06 -0.591 . . . . 71.14 111.966 -173.853 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 113.953 0.341 . . . . 73.21 113.953 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -51.09 -42.55 60.68 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.62 0.6 . . . . 74.14 112.62 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.5 m -54.86 -36.89 65.56 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.257 0.465 . . . . 64.25 112.257 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.3 p -69.77 -38.82 76.87 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.789 0.328 . . . . 74.43 110.81 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -61.62 -55.08 34.55 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.895 0.378 . . . . 73.42 111.365 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 20.6 mtpp -55.09 -45.18 75.41 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.001 -0.545 . . . . 73.41 110.875 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB1' HD11 ' A' ' 12' ' ' ILE . . . -60.48 -44.59 95.76 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.312 -0.404 . . . . 74.32 111.547 176.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.2 -54.46 40.63 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.336 0.495 . . . . 71.42 112.336 -177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.47 -22.37 63.64 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.995 -0.441 . . . . 63.21 111.864 -177.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.502 HG21 HG23 ' A' ' 152' ' ' VAL . 61.3 m -73.5 -40.44 64.07 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 122.233 -0.292 . . . . 75.51 110.526 171.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 40' ' ' ALA . 42.3 mt -55.37 -42.34 73.79 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.058 0.392 . . . . 64.0 112.058 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.489 ' NH2' ' HB3' ' A' ' 19' ' ' GLU . 1.1 ptp85 -74.16 -36.05 64.06 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.007 -0.433 . . . . 74.23 111.865 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -63.41 -44.62 94.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.777 0.322 . . . . 73.33 111.664 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.471 ' O ' HG23 ' A' ' 51' ' ' VAL . 25.6 m -87.85 -33.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.813 0.339 . . . . 64.45 111.699 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.97 -29.97 72.35 Favored Glycine 0 CA--C 1.523 0.587 0 CA-C-N 116.308 -0.406 . . . . 63.11 113.265 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.564 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 12.3 t70 -51.19 -58.02 7.25 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.955 0.407 . . . . 74.13 110.968 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.02 -45.37 95.72 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.052 -0.594 . . . . 73.23 113.038 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 47' ' ' VAL . 95.0 t -56.8 -44.86 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 122.493 -0.416 . . . . 72.11 111.742 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 48.7 mt-30 -64.73 -38.65 91.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.855 0.317 . . . . 74.52 111.855 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 79.6 mtt-85 -61.67 -37.93 85.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.114 -0.366 . . . . 73.42 111.756 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -77.15 -46.0 24.88 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.006 0.431 . . . . 74.24 111.48 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -76.78 -21.21 55.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.033 0.753 . . . . 75.32 113.033 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -50.4 -55.01 17.62 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 112.265 0.469 . . . . 74.11 112.265 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -57.34 -27.69 62.46 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 120.867 0.365 . . . . 75.15 111.85 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.54 -47.15 13.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.454 -0.339 . . . . 72.25 111.724 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.92 -30.97 70.52 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.015 0.376 . . . . 74.22 112.015 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -52.21 -36.84 53.25 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.835 0.35 . . . . 75.11 111.195 174.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.68 -29.56 64.4 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.082 -0.508 . . . . 41.3 113.167 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.457 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 63.2 mtm -90.62 -43.88 9.89 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 122.412 -0.463 . . . . 75.55 111.658 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.403 HD11 HG23 ' A' ' 105' ' ' VAL . 8.2 mp -58.87 -32.98 69.97 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.348 0.499 . . . . 75.03 112.348 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -60.96 -12.61 11.89 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.645 0.609 . . . . 74.11 112.645 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.21 5.98 9.15 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.522 0.564 . . . . 72.11 112.522 179.089 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 62' ' ' MET . 79.3 mt -88.73 -83.47 0.22 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.319 0.489 . . . . 72.14 112.319 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 49.56 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.488 0.661 . . . . 63.34 112.529 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.521 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -82.37 120.4 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.692 -0.686 . . . . 54.14 111.239 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.43 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -104.2 -14.39 15.86 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.234 0.457 . . . . 72.22 112.234 178.718 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.43 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -164.93 178.72 6.92 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.308 0.575 . . . . 74.41 112.282 173.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -48.8 -40.48 29.29 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.288 0.847 . . . . 73.12 113.288 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -58.31 -35.41 71.8 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 111.769 0.285 . . . . 74.2 111.769 -175.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.521 ' HB2' HG23 ' A' ' 68' ' ' ILE . 25.3 m-20 -67.8 -41.38 83.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.249 0.547 . . . . 65.13 110.627 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 87.8 t -56.01 -42.95 73.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 115.892 -0.595 . . . . 73.22 111.019 177.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.04 -31.47 72.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.912 -0.586 . . . . 74.43 111.525 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 t -64.86 -37.49 87.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.13 0.49 . . . . 74.23 110.675 176.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt -59.83 -31.94 70.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.231 -0.441 . . . . 73.41 111.268 176.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.2 t -57.8 -36.77 72.67 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.109 0.48 . . . . 61.2 111.173 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -64.3 -40.98 97.04 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.267 -0.424 . . . . 73.13 110.656 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.01 -43.89 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 120.947 0.403 . . . . 71.41 110.527 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.456 ' HB2' HG22 ' A' ' 128' ' ' VAL . 20.0 mmt -55.49 -38.67 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.201 0.524 . . . . 61.12 111.233 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 74.6 mt -61.06 -41.56 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.024 -0.535 . . . . 74.41 111.18 175.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -66.05 -28.55 68.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.511 -0.313 . . . . 74.04 111.533 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 86.8 t -61.65 -35.65 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 111.777 0.288 . . . . 71.22 111.777 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.561 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 20.7 m-85 . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 112.414 0.524 . . . . 75.23 112.414 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.468 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.7 m95 . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 112.403 0.52 . . . . 72.2 112.403 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.73 -25.99 45.46 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.993 -0.622 . . . . 38.55 112.654 174.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -67.24 -40.22 86.3 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.064 0.459 . . . . 74.05 110.531 175.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.7 -43.31 98.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 116.074 -0.512 . . . . 75.0 110.062 174.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.8 t -58.85 -42.42 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.894 -0.594 . . . . 71.32 110.568 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.2 m -58.66 -43.77 89.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.938 0.399 . . . . 75.42 111.278 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.561 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 32.5 tp -61.46 -55.11 34.83 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.243 0.544 . . . . 63.44 111.593 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.0 mt -66.84 -40.68 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 116.13 -0.486 . . . . 55.53 111.717 -176.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 99.9 p -64.32 -44.05 92.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.63 -0.259 . . . . 64.31 111.172 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.424 ' CD2' ' HE2' ' A' ' 81' ' ' MET . 32.6 t80 -60.8 -42.27 97.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.595 0.236 . . . . 74.23 110.994 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.66 90.41 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 120.727 -0.749 . . . . 65.24 112.193 174.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.79 -29.53 69.5 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.105 0.478 . . . . 73.13 111.597 176.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -68.17 -47.26 68.47 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.256 -0.429 . . . . 74.34 110.647 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.403 HG23 HD11 ' A' ' 63' ' ' LEU . 53.8 t -64.89 -35.9 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.428 -0.351 . . . . 63.11 110.43 175.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.87 -43.12 69.31 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.176 -0.466 . . . . 71.01 111.453 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.429 ' NZ ' ' OE1' ' A' ' 52' ' ' GLN . 52.7 mttp -57.09 -45.92 82.97 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.265 0.555 . . . . 74.12 110.721 174.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -64.04 -33.63 76.17 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.938 -0.574 . . . . 74.12 111.307 178.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.34 -49.92 67.55 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.567 -0.288 . . . . 73.32 111.108 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -58.08 -38.42 76.37 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.981 0.419 . . . . 72.33 110.796 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.2 m -57.54 -35.04 69.78 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.055 -0.52 . . . . 71.44 111.531 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 31.9 pt -106.32 31.86 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 120.96 0.41 . . . . 71.55 111.149 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.8 p30 48.94 21.73 0.49 Allowed 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.959 1.096 . . . . 75.24 113.959 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -90.62 35.88 0.89 Allowed 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.998 -0.439 . . . . 65.04 111.371 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -44.91 69.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.9 0.333 . . . . 71.25 111.9 -177.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.4 m -57.28 -27.89 62.52 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.075 0.398 . . . . 73.12 112.075 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.6 m -65.41 -25.82 67.71 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.882 0.373 . . . . 71.11 111.835 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -53.95 -40.76 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.628 0.603 . . . . 75.41 112.628 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.57 -52.56 26.48 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.379 0.511 . . . . 73.31 112.379 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -59.15 -24.97 76.27 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 121.704 1.602 . . . . 63.44 112.308 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.58 -46.64 68.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.69 -0.485 . . . . 70.04 109.69 173.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . 0.467 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -58.6 -39.21 79.75 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.291 -0.413 . . . . 72.51 111.174 174.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -57.33 -44.92 84.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.38 -0.373 . . . . 74.44 110.706 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 58.8 m -62.37 -45.13 94.56 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.373 -0.376 . . . . 73.24 111.572 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.414 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.9 mm -54.11 -53.35 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-O 121.44 0.638 . . . . 63.23 110.836 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 41.1 m -67.4 -36.39 81.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.521 -0.763 . . . . 71.51 111.704 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.7 t70 -59.93 -51.45 69.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.801 0.334 . . . . 43.3 110.598 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.456 HG22 ' HB2' ' A' ' 81' ' ' MET . 57.8 t -64.95 -41.87 93.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.049 0.452 . . . . 73.45 111.122 177.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.505 ' HG ' HD12 ' A' ' 137' ' ' LEU . 52.3 tp -54.41 -53.14 58.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.067 -0.515 . . . . 62.54 111.462 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.49 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 94.9 t -73.52 -33.1 38.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.187 -0.46 . . . . 74.35 111.415 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 24.9 tpt180 -48.58 -46.71 39.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.842 0.457 . . . . 74.12 111.917 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.553 HG22 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -114.13 -28.56 7.27 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.739 1.014 . . . . 64.34 113.739 -175.807 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.553 ' HD2' HG22 ' A' ' 132' ' ' THR . 3.5 mptp? -109.5 20.46 18.16 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.409 0.892 . . . . 64.13 113.409 -177.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 18.7 ttt180 -52.8 -53.91 41.6 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.261 0.467 . . . . 70.33 112.261 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -68.27 -40.0 82.01 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 111.866 0.321 . . . . 72.03 111.866 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -60.54 -41.39 94.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.631 0.253 . . . . 73.52 111.601 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.505 HD12 ' HG ' ' A' ' 129' ' ' LEU . 40.0 mt -54.84 -55.5 29.68 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.554 -0.294 . . . . 72.1 111.756 178.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -68.85 -41.12 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 112.218 0.451 . . . . 74.33 112.218 -178.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 66.5 mmtt -64.4 -39.36 93.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.52 0.563 . . . . 63.43 112.52 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -98.26 8.31 45.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.939 0.4 . . . . 74.52 111.411 178.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 60.41 22.73 12.3 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.012 -0.54 . . . . 70.35 112.184 178.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLY . . . . . 0.468 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 20.82 -82.23 0.0 OUTLIER Glycine 0 C--N 1.34 0.8 0 N-CA-C 116.177 1.231 . . . . 72.2 116.177 176.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.406 ' O ' HG22 ' A' ' 147' ' ' VAL . 37.4 m95 -74.87 -41.8 59.12 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.815 0.302 . . . . 71.43 111.815 -172.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -62.66 -46.21 89.27 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.468 . . . . 73.22 110.08 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.99 -31.1 77.07 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.969 -0.559 . . . . 73.52 112.537 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -59.55 -51.74 68.56 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.099 0.559 . . . . 74.02 110.976 176.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 143' ' ' TRP . 59.6 t -59.65 -39.24 79.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 115.813 -0.631 . . . . 74.3 111.514 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -73.49 -35.66 65.69 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.238 0.459 . . . . 73.12 112.238 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -62.86 -49.04 76.45 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.925 0.393 . . . . 65.45 111.473 -177.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -82.95 -16.15 48.48 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.452 -0.34 . . . . 73.01 111.237 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 83.1 t60 61.33 78.76 0.27 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.493 0.664 . . . . 72.43 112.017 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.502 HG23 HG21 ' A' ' 43' ' ' THR . 69.3 t . . . . . 0 N--CA 1.47 0.528 0 CA-C-N 115.888 -0.596 . . . . 73.35 111.737 -178.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 1' ' ' MET . 26.5 ttt . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 121.06 0.457 . . . . 61.45 111.044 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -114.11 177.04 4.78 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.499 0.666 . . . . 75.53 112.242 -174.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -103.78 163.51 12.29 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.503 -0.771 . . . . 71.14 110.394 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -57.28 -45.83 83.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.3 0.571 . . . . 63.42 110.843 175.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 69.5 tp -59.84 -38.88 83.32 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.716 -0.675 . . . . 71.42 111.089 175.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.25 -44.55 91.46 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.112 -0.494 . . . . 63.12 110.941 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mmm180 -63.49 -43.62 96.73 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.004 0.372 . . . . 74.33 112.004 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.43 ' O ' HG13 ' A' ' 12' ' ' ILE . 50.5 tt0 -60.62 -52.36 65.48 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.906 0.384 . . . . 75.32 111.35 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 p -61.6 -44.3 97.26 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.316 -0.402 . . . . 72.41 111.2 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.0 tp -54.83 -44.89 74.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.082 -0.508 . . . . 73.44 111.62 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 9.9 tp10 -61.95 -49.85 74.48 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.797 0.332 . . . . 74.5 111.166 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 8' ' ' GLN . 66.6 mt -54.84 -52.68 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.228 0.537 . . . . 74.43 111.106 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 99' ' ' ILE . 81.5 mt -64.78 -41.42 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.723 -0.671 . . . . 74.41 111.392 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -56.49 -46.29 80.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.339 -0.391 . . . . 63.42 111.418 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.561 ' NH1' ' SD ' ' A' ' 30' ' ' MET . 62.5 mtp180 -61.89 -53.89 49.52 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.455 -0.339 . . . . 75.12 111.159 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.65 -42.02 67.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.821 0.343 . . . . 75.44 111.859 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.47 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.5 mp -65.69 -42.53 91.13 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.973 0.36 . . . . 71.12 111.973 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -66.84 -40.16 87.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 122.2 -0.312 . . . . 71.31 111.594 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 45.6 mt-10 -61.73 -50.61 71.71 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.108 0.48 . . . . 51.34 111.026 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.417 ' HG3' ' HB2' ' A' ' 103' ' ' ALA . 27.3 mm-40 -59.66 -40.01 86.33 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.206 -0.452 . . . . 64.12 111.714 176.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.568 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -64.62 -42.55 95.43 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.035 0.445 . . . . 74.02 111.847 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.458 HG21 ' HE2' ' A' ' 110' ' ' LYS . 69.4 p -87.49 -7.25 57.84 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.253 -0.43 . . . . 71.14 112.039 -176.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 25.31 73.44 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 121.193 -0.527 . . . . 72.43 113.379 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -152.58 174.78 13.52 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 122.514 0.326 . . . . 62.44 110.775 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.406 ' HE2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -90.24 148.17 23.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.008 0.433 . . . . 73.44 111.585 179.189 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.83 165.73 13.11 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 116.201 -0.454 . . . . 71.12 111.833 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -108.93 -17.21 13.98 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.57 0.952 . . . . 73.34 113.57 -173.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 51.6 mtpt -55.38 154.47 11.68 Favored Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 112.808 0.67 . . . . 61.31 112.808 -176.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -70.63 175.59 8.6 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.629 2.219 . . . . 71.42 111.722 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.561 ' SD ' ' NH1' ' A' ' 15' ' ' ARG . 75.9 mmm -92.51 146.03 23.99 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.214 0.53 . . . . 73.34 112.038 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -72.98 125.87 10.02 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 114.547 0.579 . . . . 74.53 114.547 -175.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 tpt180 60.98 -80.43 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.029 0.751 . . . . 65.35 113.029 172.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.8 m -82.12 108.27 15.46 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.66 0.267 . . . . 37.75 111.401 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.36 -57.4 18.73 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 114.28 0.472 . . . . 71.22 114.28 -176.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.04 -49.95 14.19 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 122.615 -0.344 . . . . 72.21 111.855 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.8 m -55.15 -48.27 73.95 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.152 0.427 . . . . 65.32 112.152 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.467 ' HB2' ' HB3' ' A' ' 30' ' ' MET . 61.2 m -68.01 -34.67 76.95 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.701 0.286 . . . . 73.2 111.503 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.454 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -63.58 -54.92 28.45 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.733 0.301 . . . . 61.34 111.449 176.314 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HG3' HG22 ' A' ' 147' ' ' VAL . 18.5 ptmt -63.39 -36.85 85.1 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.844 0.355 . . . . 72.33 111.144 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.414 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -62.99 -46.79 86.04 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.656 0.265 . . . . 63.23 111.424 176.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.3 tp -61.06 -50.65 72.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.255 0.465 . . . . 74.52 112.255 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.8 pt-20 -64.8 -35.89 82.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 122.136 -0.353 . . . . 65.25 111.675 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 47' ' ' VAL . 53.6 m -65.96 -47.32 75.02 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.713 0.292 . . . . 72.14 110.695 174.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.3 mt -53.95 -49.43 68.73 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.229 0.455 . . . . 72.42 112.229 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.448 HH11 ' HD2' ' A' ' 45' ' ' ARG . 10.7 ptm180 -66.43 -41.62 88.92 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.116 0.413 . . . . 65.01 112.116 -176.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -70.32 -42.99 71.23 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.152 0.427 . . . . 73.23 112.152 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 43' ' ' THR . 25.4 m -82.78 -33.48 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 122.035 -0.416 . . . . 74.33 111.427 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -62.11 -40.8 99.42 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.453 -0.403 . . . . 63.31 112.675 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 17.4 t70 -55.82 -47.69 76.75 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.971 0.415 . . . . 70.43 110.921 174.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.05 -44.21 96.44 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.972 -0.632 . . . . 75.21 112.63 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.5 t -57.89 -44.36 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-O 120.742 0.306 . . . . 74.31 111.063 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.45 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 76.8 mt-30 -60.33 -42.65 96.09 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.598 -0.273 . . . . 65.51 111.373 176.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.1 mmm180 -55.2 -52.66 62.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 111.975 0.361 . . . . 74.42 111.975 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -75.33 -33.21 61.11 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.16 0.43 . . . . 71.22 112.16 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -90.91 -17.62 26.13 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.765 1.024 . . . . 74.13 113.765 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -48.72 -50.25 34.39 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 118.163 0.438 . . . . 74.34 112.163 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.2 t -55.92 -31.09 62.59 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.046 0.388 . . . . 71.32 112.046 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.63 -48.61 11.52 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.38 -0.373 . . . . 52.25 111.692 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -58.55 -47.12 85.3 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.487 -0.324 . . . . 72.44 111.703 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -52.38 -30.4 28.81 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.877 0.37 . . . . 75.34 111.758 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.16 -39.99 95.16 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.285 -0.483 . . . . 51.22 113.017 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.0 mtm -90.6 -34.71 15.37 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.269 0.557 . . . . 71.42 110.575 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -58.56 -36.87 74.6 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.955 -0.566 . . . . 71.12 111.596 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -60.11 -39.43 86.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.222 -0.445 . . . . 71.43 111.849 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 -9.78 43.03 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 111.814 0.301 . . . . 75.43 111.814 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.1 mt -82.2 -76.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.656 0.265 . . . . 75.35 110.61 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 47.21 91.89 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.527 0.731 . . . . 74.51 112.321 -178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.513 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -76.68 110.12 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.243 0.545 . . . . 71.11 112.019 -175.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HD2' ' ND2' ' A' ' 70' ' ' ASN . 0.6 OUTLIER -102.16 -6.92 22.68 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.037 -0.528 . . . . 75.14 112.094 178.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.401 ' ND2' ' HD2' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.12 169.73 15.82 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.748 0.309 . . . . 73.04 111.521 173.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -54.31 -32.09 55.65 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.546 0.573 . . . . 63.22 112.546 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.35 -35.14 67.3 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.869 0.366 . . . . 73.04 111.729 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.513 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.3 m-20 -68.92 -35.52 76.92 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.02 0.438 . . . . 70.02 110.454 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.84 -41.1 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.218 0.532 . . . . 54.2 110.519 175.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -59.07 -32.16 69.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.034 -0.53 . . . . 64.11 110.856 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -72.13 -40.26 68.23 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.144 -0.48 . . . . 70.23 110.801 174.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.1 mt -56.49 -33.68 66.21 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.558 -0.292 . . . . 74.1 111.007 176.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 82' ' ' ILE . 28.8 t -51.75 -42.18 62.14 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.299 -0.41 . . . . 74.54 111.494 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.93 -43.04 99.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.896 0.379 . . . . 72.5 111.063 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.465 ' O ' HG21 ' A' ' 84' ' ' VAL . 79.8 t -63.52 -44.19 98.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 120.948 0.404 . . . . 65.25 110.745 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -55.73 -39.23 70.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.975 -0.557 . . . . 75.22 111.625 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 78' ' ' SER . 76.5 mt -62.11 -44.36 98.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-O 121.175 0.512 . . . . 71.15 111.165 175.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -65.0 -27.9 69.14 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.395 -0.366 . . . . 73.31 111.955 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.465 HG21 ' O ' ' A' ' 80' ' ' VAL . 66.8 t -58.66 -20.99 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.807 0.337 . . . . 61.12 111.672 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.49 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 37.7 m-85 -106.43 -4.34 19.99 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.352 0.501 . . . . 74.03 112.352 177.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.2 t -70.49 5.44 1.81 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.791 0.663 . . . . 60.31 112.791 -174.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.273 0.472 . . . . 63.33 112.273 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.43 -44.29 3.17 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.077 -0.582 . . . . 75.45 113.328 -178.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.408 ' O ' ' NH2' ' A' ' 94' ' ' ARG . 34.1 m -62.85 -177.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.448 0.536 . . . . 73.2 112.448 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 74.0 p -87.0 -78.99 0.28 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 122.115 -0.366 . . . . 65.22 111.17 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 45.41 89.58 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.728 1.01 . . . . 74.21 113.728 176.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.458 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.8 m95 -60.28 -20.38 58.88 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.837 0.351 . . . . 74.54 111.234 173.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.03 -28.5 61.11 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 121.244 -0.503 . . . . 72.02 112.893 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.408 ' NH2' ' O ' ' A' ' 89' ' ' VAL . 64.3 mtm180 -70.17 -34.53 73.1 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.547 -0.384 . . . . 72.32 111.173 176.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.458 HG13 ' HE3' ' A' ' 92' ' ' TRP . 29.0 mm -58.13 -45.98 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.601 0.715 . . . . 74.55 109.437 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.76 -44.72 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 115.248 -0.887 . . . . 74.52 111.085 174.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.5 m -61.43 -35.71 78.32 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.292 -0.413 . . . . 62.33 111.344 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.49 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 22.8 tp -62.77 -55.31 27.68 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.34 0.59 . . . . 72.14 110.952 176.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.506 HG23 HG23 ' A' ' 13' ' ' ILE . 56.3 mt -67.11 -35.24 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.862 -0.608 . . . . 44.21 111.377 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.0 t -65.52 -47.08 77.17 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.004 -0.544 . . . . 65.23 111.19 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.439 ' O ' HG21 ' A' ' 105' ' ' VAL . 22.3 t80 -62.99 -39.82 95.92 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.748 0.308 . . . . 74.2 110.593 176.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.7 -46.13 89.73 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.856 -0.688 . . . . 65.42 112.274 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.47 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.878 0.37 . . . . 74.31 111.547 176.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.13 -39.34 94.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.978 0.418 . . . . 75.44 111.017 178.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.439 HG21 ' O ' ' A' ' 101' ' ' PHE . 40.6 t -75.09 -38.97 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 120.941 0.4 . . . . 72.33 110.64 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.76 82.87 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.42 0.526 . . . . 75.11 112.42 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.568 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 18.3 ptpt -62.46 -34.89 77.71 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.76 0.314 . . . . 63.4 111.006 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.417 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -65.72 -37.69 87.11 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.853 0.358 . . . . 71.04 110.505 173.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.509 HD21 ' HB ' ' A' ' 68' ' ' ILE . 87.6 mt -61.78 -50.28 72.97 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.367 -0.379 . . . . 75.23 111.609 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 66.4 tttp -63.02 -35.64 80.91 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.994 -0.441 . . . . 74.22 110.79 177.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 85.0 m -56.19 -41.67 75.91 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.928 0.394 . . . . 74.5 110.846 175.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.5 pt -97.97 20.4 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 112.08 0.4 . . . . 74.33 112.08 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 71.78 3.45 4.67 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.561 0.948 . . . . 72.52 113.561 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -84.82 45.55 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.601 0.593 . . . . 61.24 112.601 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.58 -34.25 76.6 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.117 0.414 . . . . 74.22 112.117 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.4 m -58.88 -26.52 64.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.821 0.343 . . . . 73.23 111.49 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -77.83 -27.52 49.96 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.551 -0.295 . . . . 72.4 111.714 178.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.7 mt -57.68 -46.27 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.622 0.601 . . . . 63.54 112.622 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.84 -52.05 44.11 Favored Pre-proline 0 CA--C 1.55 0.943 0 N-CA-C 112.577 0.584 . . . . 74.2 112.577 -174.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.15 -27.45 84.91 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.802 1.668 . . . . 74.43 112.134 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -64.71 -48.0 76.26 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.711 -0.477 . . . . 72.22 109.711 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.431 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -56.04 -39.97 72.8 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.001 0.429 . . . . 72.32 111.031 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.09 -36.89 85.51 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.214 -0.448 . . . . 73.11 111.061 174.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -64.42 -43.18 95.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 120.79 0.329 . . . . 74.34 111.209 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.3 mm -56.52 -52.92 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.27 0.557 . . . . 71.3 110.57 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 m -64.54 -35.17 80.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.76 -0.654 . . . . 72.24 111.39 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.33 -52.74 63.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.37 -0.377 . . . . 74.2 111.197 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' HG21 ' A' ' 132' ' ' THR . 66.5 t -64.27 -42.04 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 121.027 0.441 . . . . 62.12 110.791 177.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.542 ' HG ' HD13 ' A' ' 137' ' ' LEU . 43.1 tp -54.27 -52.87 60.03 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.866 -0.607 . . . . 74.34 111.257 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.574 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 85.0 t -74.85 -23.85 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 115.958 -0.564 . . . . 74.54 111.85 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -70.17 -46.79 63.91 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.092 0.404 . . . . 73.53 112.092 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.539 HG23 ' HG2' ' A' ' 133' ' ' LYS . 8.0 t -108.26 -34.99 6.66 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.373 0.879 . . . . 75.3 113.373 -176.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.539 ' HG2' HG23 ' A' ' 132' ' ' THR . 75.5 mmtt -99.39 18.66 17.18 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.938 -0.477 . . . . 75.21 112.017 -177.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.574 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 9.0 tpt180 -46.32 -61.71 1.67 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.101 0.56 . . . . 45.15 112.481 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -62.48 -41.41 98.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.927 -0.578 . . . . 73.14 111.985 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -59.55 -38.31 80.74 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.797 0.332 . . . . 65.2 111.509 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.542 HD13 ' HG ' ' A' ' 129' ' ' LEU . 61.7 mt -56.62 -51.15 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.395 -0.366 . . . . 73.33 111.919 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.7 p -78.16 -43.6 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 63.41 112.383 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -61.13 -50.5 72.97 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.216 0.451 . . . . 70.1 112.216 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -94.08 9.84 36.09 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.014 0.435 . . . . 74.04 111.057 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 143' ' ' TRP . 48.0 mtm180 58.89 25.58 13.84 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.74 -0.664 . . . . 75.11 111.745 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 24.53 -79.78 0.0 OUTLIER Glycine 0 N--CA 1.471 1.013 0 N-CA-C 115.562 0.985 . . . . 61.24 115.562 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.428 ' N ' ' O ' ' A' ' 141' ' ' ARG . 31.4 m95 -70.83 -46.08 63.38 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.805 0.336 . . . . 74.23 111.678 -176.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.78 -40.49 95.37 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.2 0.524 . . . . 74.23 110.218 175.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.99 -31.17 67.06 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.847 -0.615 . . . . 62.42 112.705 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -63.54 -46.37 86.31 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.108 0.563 . . . . 73.13 111.613 178.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.574 HG13 ' HB ' ' A' ' 152' ' ' VAL . 96.7 t -67.44 -36.26 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 112.33 0.493 . . . . 53.34 112.33 -178.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.704 ' HA ' ' HB2' ' A' ' 154' ' ' ASP . 12.6 pt-20 -74.01 -38.04 64.21 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 122.204 -0.31 . . . . 71.34 111.157 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.96 -48.14 83.2 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.824 0.345 . . . . 73.42 111.453 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -82.5 -1.59 50.9 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.058 0.392 . . . . 72.5 112.058 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.601 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 32.2 t60 56.65 72.48 0.5 Allowed 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.47 0.545 . . . . 73.51 112.47 175.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.574 ' HB ' HG13 ' A' ' 147' ' ' VAL . 97.6 t -103.16 -68.52 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 122.256 -0.278 . . . . 71.34 110.866 174.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -95.46 9.23 40.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.283 0.563 . . . . 72.02 110.578 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.704 ' HB2' ' HA ' ' A' ' 148' ' ' GLU . 17.6 t70 -81.38 156.88 25.22 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.983 -0.553 . . . . 71.14 111.747 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.487 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -137.19 5.95 2.8 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.089 -0.505 . . . . 53.34 111.43 178.627 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.46 ' HG3' HD22 ' A' ' 155' ' ' LEU . 41.3 mt-10 -105.58 -62.64 1.33 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.411 -0.359 . . . . 74.44 111.196 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 161.0 -33.85 0.39 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.955 -0.64 . . . . 62.51 113.62 -177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 74.83 -39.01 1.1 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 121.452 -0.404 . . . . 73.24 114.063 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -75.48 119.68 19.88 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.563 -0.375 . . . . 70.15 111.889 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -154.16 57.73 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.29 0.566 . . . . 74.34 110.842 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -67.1 122.15 17.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.951 -0.568 . . . . 62.23 112.441 -176.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -134.77 119.54 18.32 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.275 -0.42 . . . . 73.31 110.717 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -104.83 139.35 39.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.886 0.374 . . . . 53.04 111.469 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 118.857 -0.592 . . . . 74.25 111.033 176.777 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.282 0.563 . . . . 60.44 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -155.39 154.16 31.55 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.876 -0.602 . . . . 61.51 111.621 -173.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 m-20 -69.68 148.08 49.74 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.912 -0.586 . . . . 73.42 111.597 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.508 ' HG2' ' HD3' ' A' ' 32' ' ' ARG . 8.7 tp10 -65.21 -30.82 71.75 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.495 0.664 . . . . 63.53 109.262 171.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 57.0 tp -55.37 -43.82 75.48 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.454 -0.794 . . . . 73.11 110.669 170.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.437 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 58.8 t80 -60.54 -47.51 85.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.541 -0.754 . . . . 74.12 111.314 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -71.36 -31.34 67.22 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.077 0.399 . . . . 72.53 112.077 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.442 ' O ' HG13 ' A' ' 12' ' ' ILE . 41.0 tt0 -65.61 -53.34 43.03 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.169 0.509 . . . . 64.34 110.58 175.207 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 p -61.08 -42.47 98.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.808 -0.633 . . . . 62.21 110.961 178.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 tp -55.33 -47.69 75.29 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.022 -0.536 . . . . 74.33 112.047 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.94 -41.46 91.29 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.798 0.332 . . . . 74.43 111.082 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 8' ' ' GLN . 81.6 mt -59.04 -54.14 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.108 0.48 . . . . 74.25 111.074 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.427 ' O ' HD11 ' A' ' 17' ' ' LEU . 80.8 mt -61.76 -44.95 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.02 -0.537 . . . . 74.24 111.235 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.3 t -54.83 -46.6 74.63 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.772 0.32 . . . . 73.41 111.365 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.543 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 9.9 mtp180 -57.96 -58.02 10.26 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.698 0.285 . . . . 64.01 110.963 175.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.409 ' HH ' ' HA3' ' A' ' 48' ' ' GLY . 59.2 t80 -53.68 -44.72 69.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.029 -0.532 . . . . 75.52 111.991 -174.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.429 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.0 mp -59.95 -45.98 90.91 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.539 -0.3 . . . . 74.51 111.556 177.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.435 ' HG3' HH11 ' A' ' 18' ' ' ARG . 39.5 mmm-85 -65.91 -43.88 86.87 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.777 0.323 . . . . 74.4 111.399 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 42.1 mt-10 -63.26 -41.95 99.09 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.892 0.377 . . . . 44.15 111.489 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -71.43 -40.62 70.29 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.8 0.333 . . . . 73.23 111.735 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.92 97.6 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.963 0.411 . . . . 74.11 111.723 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.9 p -89.04 -16.16 32.31 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.259 0.466 . . . . 52.3 112.259 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.05 27.45 72.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.957 -0.639 . . . . 72.51 112.465 -176.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.24 -156.62 0.69 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.66 0.384 . . . . 74.31 111.188 -175.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -107.92 146.01 32.99 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.885 0.374 . . . . 73.11 111.682 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -88.44 153.59 21.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.492 -0.322 . . . . 72.04 111.327 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.7 t -89.14 -16.59 31.08 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.506 0.928 . . . . 61.23 113.506 -173.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -61.78 150.42 82.3 Favored Pre-proline 0 N--CA 1.471 0.614 0 O-C-N 122.169 -0.332 . . . . 65.32 111.533 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.457 ' O ' ' HB2' ' A' ' 30' ' ' MET . 16.1 Cg_endo -58.23 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 122.659 2.239 . . . . 71.22 113.531 -173.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.559 ' HE2' ' HA ' ' A' ' 30' ' ' MET . 5.6 tpt 174.63 -30.75 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.964 0.411 . . . . 74.33 111.563 -177.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.74 162.19 11.83 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.295 -0.478 . . . . 60.41 112.702 -178.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.508 ' HD3' ' HG2' ' A' ' 4' ' ' GLU . 56.4 ttt85 -54.6 -46.85 73.87 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.695 0.628 . . . . 73.41 112.695 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.8 m -65.03 -16.86 63.91 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.512 0.56 . . . . 75.34 112.512 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 59.55 -91.47 0.04 OUTLIER Glycine 0 CA--C 1.528 0.861 0 N-CA-C 114.286 0.475 . . . . 65.22 114.286 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.58 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -60.43 -50.83 72.03 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.063 0.394 . . . . 55.11 112.063 -176.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.3 m -58.82 -38.82 79.51 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.98 0.419 . . . . 74.31 111.477 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.5 ' HG ' ' HG3' ' A' ' 30' ' ' MET . 53.8 p -73.24 -39.07 65.76 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.535 -0.302 . . . . 53.32 111.505 -179.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.544 ' HA ' ' SD ' ' A' ' 30' ' ' MET . 11.9 ttt180 -59.54 -54.58 44.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.808 0.337 . . . . 74.52 111.265 174.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.58 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 22.5 mtpp -55.33 -41.59 72.65 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.055 -0.521 . . . . 64.3 110.894 -177.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.23 82.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.237 -0.438 . . . . 45.2 111.465 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.432 HD22 ' HE1' ' A' ' 30' ' ' MET . 63.0 tp -62.04 -53.12 60.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.126 0.417 . . . . 73.02 112.126 -179.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -66.51 -21.37 66.17 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.173 -0.33 . . . . 72.22 111.829 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.441 ' O ' HG21 ' A' ' 47' ' ' VAL . 97.4 m -77.5 -42.31 36.14 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.807 0.337 . . . . 71.55 110.265 170.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.25 -40.79 71.35 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.375 -0.375 . . . . 72.52 111.72 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.405 ' HA ' ' HE1' ' A' ' 16' ' ' TYR . 5.7 ptm180 -72.65 -37.63 67.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.055 -0.403 . . . . 64.21 111.231 178.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -66.91 -44.89 79.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.993 0.425 . . . . 63.23 111.68 -178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 51' ' ' VAL . 18.7 m -90.94 -33.65 5.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 120.891 0.377 . . . . 75.21 111.533 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.466 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.25 -47.16 83.23 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 116.076 -0.511 . . . . 71.41 113.902 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.558 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 13.7 t70 -51.71 -53.31 40.67 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 117.472 0.636 . . . . 62.1 110.621 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.88 -46.48 90.49 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.994 -0.548 . . . . 64.41 113.112 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.0 t -57.62 -42.21 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 O-C-N 122.786 -0.244 . . . . 71.35 111.033 177.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.556 ' HG2' ' HG ' ' A' ' 100' ' ' SER . 77.3 mt-30 -59.32 -53.39 58.78 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.586 -0.279 . . . . 74.04 110.982 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 9.0 mmm180 -58.33 -41.24 84.16 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.738 0.304 . . . . 73.1 111.756 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -71.42 -46.05 61.12 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.289 0.566 . . . . 72.13 111.685 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -80.16 -17.53 52.19 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.858 -0.61 . . . . 74.51 112.479 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 38.0 tt0 -48.18 -54.82 12.1 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.863 0.69 . . . . 73.44 112.863 -172.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.97 -31.55 67.0 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.902 0.382 . . . . 74.43 111.843 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.7 -36.24 60.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.842 0.353 . . . . 75.05 111.542 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -76.06 -31.76 58.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.947 0.351 . . . . 72.23 111.947 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -48.35 -39.58 22.56 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.855 0.36 . . . . 70.31 111.776 178.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.46 -37.95 61.61 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 116.052 -0.522 . . . . 74.55 113.761 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.466 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 56.9 mtm -90.45 -38.96 12.92 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.119 -0.636 . . . . 64.13 110.506 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.55 HD23 ' CE2' ' A' ' 104' ' ' PHE . 13.5 tp -54.49 -43.85 72.13 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.871 -0.604 . . . . 72.02 111.868 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -57.22 -30.18 64.37 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.811 0.671 . . . . 63.23 112.811 -177.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 62' ' ' MET . 19.0 pttp -101.26 4.82 42.12 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.866 0.365 . . . . 50.04 111.854 -177.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.4 mt -99.94 -69.57 0.76 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.704 0.288 . . . . 75.51 110.868 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 71.7 -48.63 0.68 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.479 0.918 . . . . 72.52 113.479 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.419 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.6 mp 62.97 98.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.571 0.7 . . . . 74.25 111.476 -174.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -102.15 -9.56 20.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.863 -179.332 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.434 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -163.12 177.55 9.01 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.459 0.541 . . . . 70.1 112.459 175.374 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.58 -41.85 54.93 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.847 0.684 . . . . 74.44 112.847 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.78 -39.38 68.33 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.659 0.266 . . . . 63.11 111.309 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.92 -41.93 95.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.197 0.523 . . . . 74.14 110.836 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.8 t -57.59 -48.06 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.26 0.552 . . . . 61.44 110.939 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.7 -26.24 65.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.311 -0.404 . . . . 74.15 111.321 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.0 t -65.73 -39.34 91.04 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.064 0.459 . . . . 52.21 110.682 172.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' A' ' 81' ' ' MET . 92.0 mt -59.14 -35.44 73.49 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.266 -0.425 . . . . 75.35 111.075 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.2 t -52.58 -40.43 62.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.916 0.388 . . . . 71.45 111.383 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -53.55 -35.97 61.33 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.287 -0.415 . . . . 72.12 111.46 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 58.2 t -82.72 -39.13 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.015 0.436 . . . . 75.12 111.183 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.4 mmt -54.37 -37.49 65.04 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.114 0.483 . . . . 71.41 111.366 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 78' ' ' SER . 74.7 mt -59.28 -40.03 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 116.22 -0.445 . . . . 44.45 111.518 175.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -66.62 -32.02 73.08 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 120.767 0.318 . . . . 74.34 111.474 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.3 t -57.39 -29.42 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-O 120.991 0.424 . . . . 74.24 111.542 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.45 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 25.2 m-85 -91.58 23.43 3.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.727 0.639 . . . . 72.45 112.727 178.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.5 t -51.96 -33.87 39.68 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.026 0.38 . . . . 65.34 112.026 178.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.425 ' HB3' HG23 ' A' ' 89' ' ' VAL . 1.3 m-20 -72.47 131.68 42.88 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.33 0.586 . . . . 73.3 112.107 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.02 17.88 51.08 Favored Glycine 0 CA--C 1.526 0.72 0 CA-C-N 115.911 -0.586 . . . . 42.44 111.937 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.425 HG23 ' HB3' ' A' ' 87' ' ' ASP . 28.4 m -105.87 -178.21 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.03 0.532 . . . . 44.41 111.893 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.403 HG21 ' HA ' ' A' ' 164' ' ' HIS . 14.6 t -77.38 20.57 0.29 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.078 0.77 . . . . 73.12 113.078 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -68.57 81.0 0.27 Allowed 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.664 -0.648 . . . . 71.24 111.411 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.34 -16.47 60.5 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.076 -0.511 . . . . 74.11 111.411 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.86 -24.74 50.66 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.078 -0.582 . . . . 71.31 112.763 173.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -64.46 -39.08 93.13 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.641 -0.329 . . . . 74.23 110.767 174.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.9 mm -59.35 -48.68 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.336 0.589 . . . . 74.12 110.118 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.45 -46.88 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 115.541 -0.754 . . . . 63.12 110.988 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.5 m -59.26 -48.81 80.21 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.328 -0.396 . . . . 73.25 111.655 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.495 ' HG ' HG22 ' A' ' 125' ' ' ILE . 33.0 tp -56.59 -54.53 44.9 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.221 0.534 . . . . 71.12 111.485 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 53.5 mt -67.74 -32.99 59.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 116.018 -0.537 . . . . 73.22 111.148 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.556 ' HG ' ' HG2' ' A' ' 52' ' ' GLN . 30.2 t -60.48 -51.7 68.35 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.257 -0.429 . . . . 75.13 111.291 176.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.51 ' O ' HG21 ' A' ' 105' ' ' VAL . 28.4 t80 -64.42 -37.76 88.64 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.604 -0.271 . . . . 75.35 110.782 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -48.99 78.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.872 -0.68 . . . . 43.34 112.572 175.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.429 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.62 -35.99 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.109 0.481 . . . . 64.44 111.259 176.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.55 ' CE2' HD23 ' A' ' 63' ' ' LEU . 47.4 t80 -62.46 -44.2 96.98 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.045 -0.525 . . . . 65.21 111.115 178.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.51 HG21 ' O ' ' A' ' 101' ' ' PHE . 55.9 t -66.87 -37.53 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 120.824 0.345 . . . . 71.34 110.471 175.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.66 -38.54 72.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.237 -0.438 . . . . 61.34 111.655 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.6 -45.05 93.06 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.104 0.478 . . . . 74.04 110.734 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.447 ' O ' HG12 ' A' ' 112' ' ' ILE . 82.4 t60 -64.6 -39.95 94.63 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.212 -0.449 . . . . 71.03 110.704 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.23 -49.26 78.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.358 -0.383 . . . . 71.42 111.564 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -59.99 -44.13 94.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.095 0.474 . . . . 60.42 110.466 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.8 m -56.7 -45.09 82.04 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.113 -0.494 . . . . 75.34 111.706 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 108' ' ' HIS . 35.7 pt -87.15 12.66 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-O 120.92 0.391 . . . . 71.23 111.773 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 67.99 16.58 9.56 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.041 0.756 . . . . 61.3 113.041 174.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -92.74 38.86 1.03 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.83 0.348 . . . . 73.32 110.942 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.24 -32.95 67.08 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.083 0.401 . . . . 61.05 112.083 -176.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.5 p -56.26 -38.34 71.03 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.847 0.356 . . . . 74.55 111.704 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.5 m -61.96 -26.74 68.38 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.68 0.622 . . . . 75.43 112.68 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.8 mt -54.5 -45.36 70.57 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 112.874 0.694 . . . . 74.32 112.874 -176.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.32 -52.71 35.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 112.44 0.533 . . . . 73.44 112.44 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -26.11 81.66 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.75 1.633 . . . . 63.11 112.262 173.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.6 tt -66.16 -44.39 84.22 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.635 -0.505 . . . . 75.21 109.635 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.3 -37.67 75.54 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.219 -0.446 . . . . 70.45 110.896 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.05 -39.3 94.32 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.562 -0.29 . . . . 64.44 111.414 174.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.7 m -63.15 -45.71 90.63 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.016 0.436 . . . . 70.04 110.986 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.495 HG22 ' HG ' ' A' ' 98' ' ' LEU . 48.6 mm -56.58 -52.78 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.297 0.57 . . . . 65.33 110.794 175.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.6 m -65.91 -34.81 78.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.804 -0.635 . . . . 72.3 111.974 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 20.3 t70 -63.14 -50.27 71.08 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.458 -0.337 . . . . 71.52 110.53 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.419 HG22 ' HB2' ' A' ' 81' ' ' MET . 59.7 t -63.05 -39.82 86.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.053 0.454 . . . . 51.2 111.084 176.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.521 ' HG ' HD11 ' A' ' 137' ' ' LEU . 60.1 tp -53.28 -53.12 55.44 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.185 0.517 . . . . 72.03 111.338 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.491 ' HA ' ' HB3' ' A' ' 134' ' ' ARG . 42.0 t -73.6 -31.15 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 CA-C-N 116.038 -0.528 . . . . 43.34 111.756 177.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.7 tpt180 -52.54 -42.42 64.4 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.212 0.605 . . . . 61.41 112.389 -176.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.677 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.6 t -126.16 -21.67 4.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.723 1.009 . . . . 75.44 113.723 -175.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.677 ' HG2' HG23 ' A' ' 132' ' ' THR . 32.5 mmtp -122.67 13.27 10.01 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.293 0.849 . . . . 73.42 113.293 -173.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.625 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 0.2 OUTLIER -60.26 -40.46 90.43 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.537 0.684 . . . . 73.33 110.913 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' A' ' 134' ' ' ARG . 33.0 t70 -59.44 -50.63 73.2 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.146 -0.934 . . . . 53.44 110.803 177.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -59.05 -36.83 75.71 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.739 0.304 . . . . 71.22 111.549 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.521 HD11 ' HG ' ' A' ' 129' ' ' LEU . 88.1 mt -57.91 -49.33 77.1 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.436 -0.347 . . . . 74.22 111.791 176.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.8 p -77.6 -31.98 17.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 112.041 0.386 . . . . 55.1 112.041 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.4 mmtt -64.34 -58.58 6.09 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.08 0.466 . . . . 74.44 111.813 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -91.73 -1.32 57.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.089 0.403 . . . . 73.51 112.089 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 59.84 80.83 0.19 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.248 0.547 . . . . 65.43 110.242 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -55.31 -50.75 58.34 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.474 -0.784 . . . . 71.11 114.352 -171.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.414 ' O ' HG22 ' A' ' 147' ' ' VAL . 26.1 m95 -73.84 -36.27 64.89 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 117.014 0.407 . . . . 74.54 111.903 -175.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.22 -51.67 65.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.487 0.661 . . . . 61.43 110.741 174.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.07 -31.66 78.44 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.486 -0.779 . . . . 51.11 113.101 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.89 -45.21 82.71 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.118 0.485 . . . . 75.52 111.288 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 143' ' ' TRP . 48.2 t -65.61 -46.01 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.96 -0.564 . . . . 61.54 112.168 -178.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -27.73 61.24 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.101 0.408 . . . . 71.0 112.101 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -57.3 -49.1 77.19 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.215 0.531 . . . . 72.32 110.953 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -83.66 -0.3 50.09 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.263 -0.426 . . . . 73.2 111.472 173.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 19.3 t60 60.17 37.73 20.58 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.335 0.654 . . . . 73.15 112.055 175.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.44 HG12 ' HG3' ' A' ' 153' ' ' GLU . 60.0 t -76.23 -69.69 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-O 120.873 0.368 . . . . 71.12 110.922 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.44 ' HG3' HG12 ' A' ' 152' ' ' VAL . 53.4 mt-10 -125.34 61.86 1.2 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.085 0.469 . . . . 70.45 111.284 177.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.38 144.38 53.42 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.245 -0.434 . . . . 65.23 111.139 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.472 HD11 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -107.51 -7.65 16.48 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.789 0.328 . . . . 64.3 111.583 179.587 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 62.31 2.72 0.9 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.588 0.958 . . . . 73.14 113.588 173.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -77.84 66.87 3.02 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 121.164 -0.541 . . . . 74.41 112.572 175.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 71.46 -151.26 48.01 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 121.399 -0.429 . . . . 71.51 113.547 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 69.86 -61.7 0.44 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.795 0.838 . . . . 64.11 113.026 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -44.42 103.86 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.124 1.157 . . . . 71.43 114.124 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -142.19 96.61 2.99 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.351 -0.84 . . . . 71.44 110.036 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -83.05 71.99 10.11 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.286 0.565 . . . . 71.25 111.853 -175.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -86.31 113.45 22.31 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.175 -0.466 . . . . 72.22 110.865 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.403 ' HA ' HG21 ' A' ' 90' ' ' THR . 40.3 t-80 . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.735 -0.65 . . . . 73.54 112.354 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 mmt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.963 0.411 . . . . 63.35 110.217 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.734 ' HG3' ' HD3' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -163.39 166.5 22.8 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.018 0.437 . . . . 75.13 112.075 -172.514 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.52 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 4.0 p30 -121.43 178.38 4.82 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 116.181 -0.463 . . . . 54.4 111.209 176.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.42 -46.08 91.28 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.385 0.513 . . . . 72.24 112.385 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.551 HD23 ' HG3' ' A' ' 134' ' ' ARG . 65.0 tp -61.28 -42.74 99.16 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.08 0.467 . . . . 73.45 110.628 -179.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -56.42 -45.29 80.78 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.764 -0.653 . . . . 72.41 111.037 174.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.734 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 25.3 mmm180 -66.71 -48.47 69.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.127 0.417 . . . . 75.41 112.127 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.418 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.6 tt0 -62.1 -51.4 68.06 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.063 0.459 . . . . 73.34 110.964 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.2 p -57.13 -37.74 72.44 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.04 0.447 . . . . 75.33 110.627 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.522 HD13 ' HG2' ' A' ' 123' ' ' GLU . 44.1 tp -60.09 -46.04 90.93 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.919 -0.582 . . . . 72.35 111.993 178.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.9 pt-20 -67.09 -40.76 87.01 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 120.452 -0.499 . . . . 71.11 110.939 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.427 ' N ' ' HG3' ' A' ' 11' ' ' GLU . 66.3 mt -57.21 -53.6 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.158 0.504 . . . . 72.25 110.964 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.457 HG22 HG22 ' A' ' 99' ' ' ILE . 84.3 mt -66.91 -45.69 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 115.852 -0.613 . . . . 61.01 111.502 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 27.7 t -56.52 -53.94 51.66 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.406 -0.361 . . . . 71.44 111.416 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.631 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 40.3 mtt180 -55.95 -49.75 72.67 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.305 -0.257 . . . . 74.44 110.305 176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.469 ' CD2' HG23 ' A' ' 99' ' ' ILE . 62.7 t80 -52.54 -44.91 66.09 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.994 0.368 . . . . 71.51 111.994 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.539 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.8 mp -60.66 -40.83 93.51 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.371 -0.205 . . . . 74.44 111.21 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 14' ' ' SER . 31.3 mmm-85 -64.63 -42.41 95.51 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.952 0.406 . . . . 70.13 110.876 177.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 4.7 mm-40 -56.66 -49.94 73.55 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.594 0.712 . . . . 64.13 110.881 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -75.43 -30.8 60.15 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.702 -0.681 . . . . 73.12 112.463 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -38.14 73.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.021 0.439 . . . . 70.42 111.637 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.3 p -87.69 -36.97 17.1 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.233 -0.439 . . . . 73.32 111.231 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.95 -0.8 59.2 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-N 116.28 -0.418 . . . . 71.0 112.517 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.06 -159.89 0.7 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 122.601 0.361 . . . . 73.24 111.408 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.43 ' HD2' ' NH2' ' A' ' 45' ' ' ARG . 29.0 mtmm -131.43 149.71 52.43 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.064 0.459 . . . . 65.03 111.734 176.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -77.84 159.39 29.0 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.112 -0.494 . . . . 65.45 110.826 170.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.3 t -134.96 9.18 3.54 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.987 0.422 . . . . 65.21 111.368 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -83.98 153.69 63.68 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-O 120.712 0.291 . . . . 64.12 111.538 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -50.8 151.18 11.42 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.899 2.4 . . . . 74.15 113.679 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.553 ' HA ' ' NH2' ' A' ' 15' ' ' ARG . 4.2 tpt -80.01 165.68 22.33 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 116.236 -0.438 . . . . 75.41 110.628 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.35 -86.42 0.16 Allowed Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.309 -0.472 . . . . 52.42 113.092 -178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -104.87 -76.85 0.59 Allowed 'General case' 0 N--CA 1.472 0.646 0 O-C-N 122.314 -0.521 . . . . 63.24 111.575 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 t -75.25 121.68 22.53 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.161 0.505 . . . . 73.03 110.818 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -86.84 -50.48 3.71 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.822 -0.627 . . . . 74.43 113.487 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.577 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -74.84 -52.21 11.97 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.405 0.521 . . . . 63.52 112.405 -174.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.1 m -59.13 -51.34 70.45 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 120.947 0.403 . . . . 74.23 111.443 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.7 m -60.48 -32.69 71.66 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.337 -0.392 . . . . 74.52 111.65 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -69.14 -48.64 61.83 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.017 0.436 . . . . 73.11 110.881 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 26.3 mtpp -56.59 -48.37 77.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.427 0.632 . . . . 70.55 110.667 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.71 77.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.758 -0.655 . . . . 73.42 111.9 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -54.8 -52.84 61.38 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.297 0.48 . . . . 73.1 112.297 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.41 -42.25 98.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.671 0.272 . . . . 61.25 111.366 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.481 ' O ' HG21 ' A' ' 47' ' ' VAL . 95.6 m -63.95 -35.45 80.74 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.755 -0.202 . . . . 64.02 111.484 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 41.6 mt -53.91 -52.11 61.59 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.625 0.25 . . . . 74.32 111.673 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' NH2' ' HD2' ' A' ' 25' ' ' LYS . 15.9 ptt180 -77.24 -29.36 53.99 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.198 -0.314 . . . . 74.42 111.758 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.401 ' NH1' HG13 ' A' ' 152' ' ' VAL . 42.2 ttm180 -61.54 -44.45 97.02 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.421 -0.354 . . . . 72.03 111.56 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 43' ' ' THR . 22.3 m -93.78 -33.27 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.143 0.497 . . . . 73.02 111.135 176.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.507 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -56.82 -59.48 10.75 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.706 -0.679 . . . . 53.33 113.271 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.542 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 24.6 t70 -53.12 -34.01 54.86 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 117.322 0.561 . . . . 53.44 111.406 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.3 -49.33 75.45 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.216 -0.516 . . . . 44.32 112.598 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.62 -37.07 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-O 120.817 0.341 . . . . 72.41 111.464 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.8 mt-30 -56.92 -52.1 66.49 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.398 -0.365 . . . . 75.3 111.263 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 34.6 mmm-85 -62.09 -27.95 69.28 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.987 0.365 . . . . 64.03 111.987 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-20 -72.05 -41.95 66.84 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.373 0.606 . . . . 74.12 110.763 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -85.19 -15.67 42.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.499 -0.773 . . . . 61.33 112.582 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 52' ' ' GLN . 43.3 tt0 -47.32 -44.98 24.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.305 0.642 . . . . 75.51 112.717 -170.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.6 t -55.55 -42.56 74.81 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.952 0.406 . . . . 73.4 111.737 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.86 -48.28 32.25 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.795 0.331 . . . . 51.01 111.794 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -57.49 -44.11 84.69 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.559 -0.291 . . . . 72.12 111.749 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -55.01 -39.65 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.121 0.486 . . . . 75.41 110.835 174.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -63.77 -28.74 73.07 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-N 116.055 -0.521 . . . . 55.01 112.787 176.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 82.7 mtp -79.09 -47.98 15.15 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.094 0.473 . . . . 74.21 110.687 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.63 -34.84 73.3 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.294 0.479 . . . . 75.12 112.294 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.0 ptt180 -67.79 -16.7 64.24 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 111.968 0.359 . . . . 62.41 111.968 -178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 11.27 22.49 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.087 0.47 . . . . 71.45 111.161 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 -73.66 0.64 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.026 -0.534 . . . . 73.1 111.221 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 70.45 -43.86 0.56 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 113.766 1.024 . . . . 73.12 113.766 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.441 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.5 mp 62.83 90.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.445 0.64 . . . . 64.15 111.026 -174.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -12.6 33.13 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.975 -0.557 . . . . 75.42 111.935 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.23 175.28 13.61 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.359 0.599 . . . . 73.12 112.274 176.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.553 ' HG2' ' HZ1' ' A' ' 75' ' ' LYS . 36.7 tt0 -57.08 -35.26 69.17 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.678 -0.692 . . . . 63.41 112.71 -177.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -62.58 -29.2 70.42 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.279 0.474 . . . . 75.22 112.279 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -66.68 -41.45 88.08 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.076 0.465 . . . . 62.55 110.144 174.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.3 t -57.37 -39.95 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.017 -0.538 . . . . 64.23 110.525 174.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.553 ' HZ1' ' HG2' ' A' ' 71' ' ' GLU . 63.1 mttp -59.17 -42.05 89.88 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.168 0.509 . . . . 63.12 110.628 173.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.5 t -67.8 -35.83 79.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.028 -0.533 . . . . 72.4 111.745 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -55.78 -30.63 61.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.658 0.266 . . . . 74.02 111.523 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.448 ' O ' HG13 ' A' ' 82' ' ' ILE . 22.6 t -52.94 -37.41 60.95 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.009 0.433 . . . . 74.12 111.131 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -59.69 -49.11 79.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.112 0.482 . . . . 70.12 111.104 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.28 -41.46 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.97 -0.559 . . . . 65.44 110.996 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.405 ' SD ' HD11 ' A' ' 98' ' ' LEU . 22.4 mmt -58.04 -37.78 75.02 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.951 -0.568 . . . . 63.35 111.464 178.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 78' ' ' SER . 80.1 mt -63.42 -38.12 81.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 120.845 0.355 . . . . 75.14 111.045 173.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -62.23 -33.42 74.55 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.669 0.271 . . . . 73.53 111.613 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.519 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 95.7 t -56.27 -34.64 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-O 120.988 0.423 . . . . 74.21 111.442 177.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.481 ' CZ ' HD21 ' A' ' 98' ' ' LEU . 74.2 m-85 -85.78 10.21 14.3 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.563 0.579 . . . . 72.41 112.563 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.3 t -68.67 -46.92 67.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.958 0.409 . . . . 72.13 111.494 177.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.629 ' HB2' ' HD2' ' A' ' 94' ' ' ARG . 3.7 m-20 -62.38 116.45 5.08 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.124 -0.489 . . . . 75.1 111.758 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.44 61.44 2.76 Favored Glycine 0 CA--C 1.529 0.965 0 C-N-CA 121.477 -0.392 . . . . 74.41 113.06 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 59.6 t -74.35 -17.63 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.653 0.381 . . . . 52.15 111.982 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 35.1 p 63.58 -62.11 0.15 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.237 1.015 . . . . 71.21 111.971 -174.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -55.64 159.82 2.79 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.329 0.585 . . . . 71.42 112.519 176.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -69.24 11.32 0.23 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.182 0.808 . . . . 73.13 113.182 -175.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.78 -37.76 70.5 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 121.189 -0.529 . . . . 74.04 113.061 177.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.629 ' HD2' ' HB2' ' A' ' 87' ' ' ASP . 3.7 mmp_? -61.6 -36.78 81.66 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.77 0.319 . . . . 71.23 111.781 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.01 -44.89 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.121 0.486 . . . . 74.03 110.723 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -58.41 -49.64 81.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.037 -0.529 . . . . 74.34 111.055 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.4 m -57.05 -47.66 80.42 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.796 0.331 . . . . 71.41 111.49 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.481 HD21 ' CZ ' ' A' ' 85' ' ' PHE . 31.6 tp -58.65 -55.77 30.85 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.193 0.52 . . . . 62.44 112.068 -178.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.469 HG23 ' CD2' ' A' ' 16' ' ' TYR . 41.4 mt -70.46 -34.82 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 116.188 -0.46 . . . . 71.43 111.587 -174.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.5 m -66.54 -41.9 88.01 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.764 -0.198 . . . . 73.44 111.38 177.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.7 t80 -62.16 -43.8 98.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.705 0.288 . . . . 63.32 110.691 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.98 -45.57 86.47 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.891 -0.671 . . . . 70.13 112.375 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.539 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.83 -33.78 76.36 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.844 0.354 . . . . 73.21 111.816 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -65.61 -43.27 90.09 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.96 0.41 . . . . 73.24 110.54 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 101' ' ' PHE . 48.9 t -65.91 -38.47 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-O 120.851 0.358 . . . . 65.12 110.439 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.63 -41.2 69.76 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.185 -0.462 . . . . 64.21 111.865 177.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -54.34 -48.91 70.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.528 0.68 . . . . 71.32 110.619 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.466 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.4 t60 -67.05 -39.71 86.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.76 -0.655 . . . . 74.22 111.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -58.65 -50.14 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.737 0.303 . . . . 65.41 111.331 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.57 -45.95 90.33 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.084 0.469 . . . . 72.13 111.035 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 63.2 m -55.68 -40.23 72.02 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.937 -0.574 . . . . 64.44 112.231 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.4 pt -96.57 21.2 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.507 0.558 . . . . 64.21 112.507 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 69.16 10.43 7.84 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.832 0.679 . . . . 65.2 112.832 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -92.12 27.45 2.17 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.024 0.44 . . . . 73.22 110.589 175.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.483 ' HG3' HD12 ' A' ' 118' ' ' ILE . 70.8 tt0 -58.93 -34.86 72.21 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.342 0.497 . . . . 72.15 112.342 -174.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.9 m -56.92 -31.98 65.47 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.927 0.394 . . . . 75.52 111.195 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -64.74 -26.37 68.33 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.396 0.517 . . . . 74.32 112.396 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.483 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.0 mt -53.67 -41.22 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 112.725 0.639 . . . . 72.54 112.725 -176.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.04 -54.64 9.44 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 112.403 0.519 . . . . 74.24 112.403 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.13 -29.34 86.93 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 121.712 1.608 . . . . 75.13 112.263 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.7 tt -65.01 -46.39 81.55 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.867 -0.42 . . . . 75.04 109.867 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -56.93 -40.78 77.01 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.819 173.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.522 ' HG2' HD13 ' A' ' 10' ' ' LEU . 42.1 mt-10 -63.98 -32.87 74.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.095 -0.502 . . . . 73.23 111.162 177.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.0 m -68.01 -38.64 82.84 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.59 0.234 . . . . 72.44 111.186 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -58.34 -53.27 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.227 0.537 . . . . 75.44 110.405 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 61.0 m -64.11 -35.15 79.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.838 -0.619 . . . . 74.03 111.203 176.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.519 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 23.3 t70 -59.97 -52.58 64.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.536 0.199 . . . . 74.5 111.536 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 96.3 t -63.65 -45.46 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.14 0.495 . . . . 63.45 110.651 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.55 ' HG ' HD11 ' A' ' 137' ' ' LEU . 46.4 tp -51.58 -52.13 49.83 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.785 -0.643 . . . . 75.54 111.079 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.529 HG12 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -69.36 -37.04 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.89 -0.595 . . . . 70.32 111.836 177.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.4 tpt180 -58.4 -35.89 72.71 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.17 -0.468 . . . . 72.03 112.151 -174.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 1.6 t -123.26 -16.74 6.82 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.365 0.876 . . . . 74.43 113.365 -177.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -132.39 16.49 4.48 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.965 1.098 . . . . 72.33 113.965 -172.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.551 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.7 ttp180 -60.33 -50.8 72.17 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.786 0.721 . . . . 75.15 111.304 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 30.7 t70 -55.64 -44.74 77.43 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.061 0.458 . . . . 75.02 110.653 177.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -63.34 -36.59 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.366 -0.379 . . . . 74.31 111.867 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.55 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.0 mt -57.0 -50.44 72.71 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.679 0.276 . . . . 72.44 111.275 174.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -77.8 -32.28 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 112.546 0.573 . . . . 74.33 112.546 -177.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.6 mmtt -72.36 -51.9 18.5 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.069 -0.395 . . . . 70.03 111.585 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -86.1 -9.33 56.89 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.467 -0.333 . . . . 73.41 111.762 -177.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mtt-85 61.61 60.16 1.69 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.403 0.621 . . . . 71.54 110.124 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -48.06 -49.62 23.62 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 115.1 -0.954 . . . . 53.22 115.354 -171.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -69.07 -43.19 75.08 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 117.428 0.614 . . . . 74.24 112.046 -174.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.5 -32.8 73.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.212 0.529 . . . . 64.54 110.83 174.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.519 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -74.3 -30.53 60.51 Favored Glycine 0 CA--C 1.525 0.66 0 CA-C-N 116.002 -0.544 . . . . 71.21 112.74 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -57.33 -42.94 82.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 73.31 111.133 177.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.484 HG12 ' HE3' ' A' ' 39' ' ' LYS . 30.8 t -68.03 -42.17 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 115.926 -0.579 . . . . 74.31 111.781 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.519 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.9 pt-20 -71.82 -32.1 67.23 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.655 0.264 . . . . 73.43 111.518 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.67 -49.36 78.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.853 0.359 . . . . 74.33 111.523 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -83.58 -1.8 54.64 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.819 0.303 . . . . 75.43 111.819 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.473 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 37.3 t60 59.66 21.91 10.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.741 0.416 . . . . 74.21 111.915 175.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.501 HG12 ' HG3' ' A' ' 153' ' ' GLU . 94.6 t -56.02 -61.93 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.976 0.417 . . . . 74.2 112.089 -176.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.501 ' HG3' HG12 ' A' ' 152' ' ' VAL . 52.8 mt-10 -115.94 27.75 9.08 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.399 0.619 . . . . 60.13 110.657 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.473 ' HB3' ' HA ' ' A' ' 151' ' ' HIS . 5.3 t70 -102.96 154.15 19.51 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.55 -0.75 . . . . 73.11 110.955 177.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.545 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -130.53 5.19 4.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.094 0.776 . . . . 75.44 113.094 -175.776 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -110.21 -41.13 4.5 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 112.442 0.534 . . . . 72.41 112.442 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 135.12 -12.72 4.4 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.462 -0.399 . . . . 41.41 112.624 -177.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 75.89 -145.76 32.87 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.262 -0.495 . . . . 54.31 113.15 -178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -42.7 107.64 0.08 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.265 0.555 . . . . 72.24 112.004 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -93.65 -10.01 35.97 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.401 -0.363 . . . . 72.23 111.562 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -154.43 121.53 5.63 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 120.961 0.41 . . . . 74.35 111.649 178.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -76.85 156.97 31.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.396 0.517 . . . . 73.04 112.396 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -157.8 139.76 14.14 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 72.34 111.027 175.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.7 p80 . . . . . 0 C--O 1.254 1.337 0 N-CA-C 112.321 0.489 . . . . 74.33 112.321 -178.624 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.617 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 121.117 0.484 . . . . 75.52 110.903 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.95 168.77 16.15 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.434 0.531 . . . . 54.31 112.434 -170.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.16 155.2 39.39 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.349 0.87 . . . . 73.44 113.349 -174.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.444 ' OE2' ' HD3' ' A' ' 32' ' ' ARG . 40.6 tt0 -56.48 -44.45 80.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.336 -0.847 . . . . 73.43 110.702 173.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.418 HD13 ' HB3' ' A' ' 137' ' ' LEU . 60.0 tp -54.69 -43.71 72.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.838 -0.619 . . . . 65.34 111.782 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -68.31 -50.4 53.72 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.813 0.34 . . . . 72.04 111.365 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -63.55 -37.84 88.83 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.096 0.406 . . . . 74.41 112.096 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -69.44 -52.25 28.52 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.425 -0.352 . . . . 74.33 111.189 178.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -59.44 -51.86 68.08 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.716 0.293 . . . . 74.53 111.285 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.3 -45.0 65.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.284 -0.416 . . . . 74.31 111.689 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.518 ' HG2' ' HD2' ' A' ' 15' ' ' ARG . 28.2 tt0 -62.79 -51.56 66.62 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.72 0.295 . . . . 64.45 111.228 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 8' ' ' GLN . 72.0 mt -55.24 -48.76 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.072 0.463 . . . . 63.33 111.444 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.453 ' O ' HD11 ' A' ' 17' ' ' LEU . 75.9 mt -64.04 -50.27 77.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 116.117 -0.492 . . . . 73.31 111.571 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 28.7 t -53.62 -54.23 40.57 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.812 0.339 . . . . 74.41 111.769 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.564 HH12 ' HA ' ' A' ' 30' ' ' MET . 55.0 mtp180 -58.06 -50.29 73.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.299 -0.409 . . . . 75.34 111.386 -178.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.64 -47.45 73.49 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.796 0.331 . . . . 70.34 111.444 177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.453 HD11 ' O ' ' A' ' 13' ' ' ILE . 8.3 mp -59.11 -45.45 90.87 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.781 0.289 . . . . 73.43 111.781 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.4 mmm180 -62.58 -53.06 60.22 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.652 0.263 . . . . 72.53 111.217 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 10.1 pt-20 -64.86 -35.02 79.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.832 0.349 . . . . 73.34 111.889 -178.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.48 ' HG2' ' HB1' ' A' ' 103' ' ' ALA . 8.1 tp-100 -69.5 -25.75 64.2 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.959 0.409 . . . . 73.2 111.121 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.71 -31.29 21.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.122 0.416 . . . . 71.33 112.122 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.479 HG23 ' O ' ' A' ' 18' ' ' ARG . 66.4 p -87.71 -37.75 16.41 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.191 0.441 . . . . 73.54 112.191 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.93 -6.94 57.04 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 116.216 -0.447 . . . . 65.25 112.379 -173.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -114.64 114.71 26.05 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.658 -0.319 . . . . 75.13 111.317 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -66.51 141.18 57.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.09 0.471 . . . . 74.12 112.068 -177.348 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -76.8 163.58 26.65 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-O 121.155 0.502 . . . . 74.43 112.191 -173.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.0 t -148.67 19.96 1.03 Allowed 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.96 0.726 . . . . 75.12 112.96 -176.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -69.64 162.89 64.22 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 122.063 -0.398 . . . . 73.31 111.696 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -51.89 133.15 44.83 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.297 1.998 . . . . 72.32 111.845 171.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.564 ' HA ' HH12 ' A' ' 15' ' ' ARG . 7.7 tpt -84.05 163.92 19.59 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.818 0.342 . . . . 74.24 111.701 -174.122 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.2 171.72 0.58 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 116.412 -0.358 . . . . 37.66 113.591 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.444 ' HD3' ' OE2' ' A' ' 4' ' ' GLU . 50.0 ttt-85 -44.18 -51.69 7.94 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.485 0.55 . . . . 75.42 112.485 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -73.07 117.96 15.44 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.772 0.32 . . . . 64.13 110.352 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.77 -81.91 0.68 Allowed Glycine 0 CA--C 1.526 0.777 0 C-N-CA 121.256 -0.497 . . . . 53.32 113.701 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.71 -50.36 60.67 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.572 0.582 . . . . 55.11 112.572 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.2 m -55.17 -51.62 65.92 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.125 0.417 . . . . 71.45 112.125 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.6 m -60.61 -42.44 96.81 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.921 0.341 . . . . 74.22 111.921 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.79 -42.08 96.86 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.046 0.451 . . . . 73.43 110.891 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -64.34 -43.64 93.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.892 -0.595 . . . . 70.2 111.408 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.51 -55.12 37.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.764 0.316 . . . . 71.01 111.538 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.2 tp -54.7 -41.68 70.57 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.204 0.526 . . . . 75.14 110.973 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -62.5 -47.14 85.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.818 -0.628 . . . . 72.51 111.479 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 89.2 m -61.87 -41.39 97.79 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.134 -0.484 . . . . 74.41 111.521 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.3 mt -53.6 -33.67 55.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.181 0.438 . . . . 71.01 112.181 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.523 ' HD3' ' OE2' ' A' ' 19' ' ' GLU . 42.7 mtm-85 -72.75 -55.29 6.98 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.855 0.317 . . . . 70.35 111.855 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -63.1 -37.19 86.23 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.819 0.674 . . . . 63.1 112.819 -176.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 43' ' ' THR . 15.5 m -91.96 -31.18 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 O-C-N 122.052 -0.405 . . . . 70.21 111.948 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.52 -43.78 85.32 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 121.291 -0.48 . . . . 42.23 114.061 -175.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -51.7 -53.5 38.52 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 117.0 0.4 . . . . 64.02 111.977 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.82 -46.74 74.98 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 121.105 -0.569 . . . . 70.43 112.864 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.6 t -58.46 -49.16 83.15 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 120.818 0.342 . . . . 74.44 111.117 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -57.12 -44.24 83.09 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.365 -0.38 . . . . 72.3 111.929 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -68.73 -51.07 45.37 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.331 0.493 . . . . 61.32 112.331 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -61.9 -36.81 82.43 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.412 0.625 . . . . 73.2 111.385 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.32 -16.67 57.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.501 -0.772 . . . . 74.33 112.988 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.32 -50.0 22.79 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.911 0.708 . . . . 72.12 112.911 -171.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.9 t -53.81 -40.43 66.36 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.859 0.361 . . . . 61.13 111.791 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.57 -41.33 60.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.724 0.297 . . . . 73.21 111.547 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -62.69 -47.58 83.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.402 -0.363 . . . . 71.45 111.535 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -53.11 -39.02 63.1 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.131 0.491 . . . . 72.12 110.993 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.53 -29.57 69.84 Favored Glycine 0 CA--C 1.528 0.845 0 CA-C-N 115.945 -0.571 . . . . 63.43 113.063 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 63.5 mtm -89.61 -42.11 11.59 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 122.379 -0.483 . . . . 73.44 111.596 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -55.09 -35.51 64.68 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.232 0.456 . . . . 71.2 112.232 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -63.56 -22.05 66.68 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 112.495 0.554 . . . . 74.04 112.495 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.419 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -108.2 10.58 27.86 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.424 0.631 . . . . 72.52 111.21 174.42 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.419 ' HG ' ' HD2' ' A' ' 65' ' ' LYS . 91.6 mt -117.18 -76.18 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.775 -0.648 . . . . 62.04 110.274 175.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.9 t0 71.12 -40.72 0.48 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.287 1.035 . . . . 65.01 113.426 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.546 HD13 HD22 ' A' ' 77' ' ' LEU . 3.0 mp 60.42 94.25 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.975 0.91 . . . . 63.34 112.541 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.76 -10.1 17.66 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.201 -0.454 . . . . 74.34 111.165 176.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.462 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -158.73 169.58 24.07 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.39 -0.368 . . . . 72.15 111.252 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.52 -32.19 66.8 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.171 0.804 . . . . 73.14 113.171 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.21 -33.38 58.14 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.946 0.403 . . . . 74.51 111.722 177.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -71.46 -39.56 70.87 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.015 0.436 . . . . 70.3 110.458 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -58.67 -45.45 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.253 0.549 . . . . 74.15 110.805 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.59 -33.19 73.47 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.195 0.522 . . . . 61.23 111.077 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.6 m -69.21 -29.19 67.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.165 -0.47 . . . . 61.33 111.327 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.546 HD22 HD13 ' A' ' 68' ' ' ILE . 94.0 mt -61.77 -35.39 77.99 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.78 0.324 . . . . 64.14 110.813 174.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -55.47 -39.2 70.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.064 0.459 . . . . 74.01 111.013 175.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -62.3 -41.55 98.61 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.238 -0.437 . . . . 73.43 110.706 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.425 ' O ' HG22 ' A' ' 84' ' ' VAL . 83.7 t -59.35 -43.51 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 120.928 0.394 . . . . 62.24 110.47 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.9 mmt -56.74 -43.61 80.89 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.994 -0.548 . . . . 75.1 111.16 177.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 69.6 mt -59.08 -34.5 53.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.183 0.516 . . . . 70.51 110.964 175.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -73.08 -32.24 64.88 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 116.199 -0.455 . . . . 75.43 111.366 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 80' ' ' VAL . 88.0 t -59.45 -38.38 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-O 120.903 0.383 . . . . 73.11 111.924 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.404 ' CE2' HD22 ' A' ' 98' ' ' LEU . 72.6 m-85 -88.57 32.76 0.77 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.192 0.441 . . . . 72.34 112.192 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.3 t -65.01 -19.83 66.19 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.988 0.423 . . . . 64.01 111.354 175.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.13 144.09 50.37 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.027 0.442 . . . . 50.45 111.641 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.78 -19.51 47.53 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.035 -0.602 . . . . 37.66 113.314 -178.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 28.4 m -75.58 143.62 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.244 0.545 . . . . 75.23 112.365 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 35.7 m -88.77 91.68 8.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.138 -0.483 . . . . 74.14 110.532 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -130.49 133.79 46.56 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.247 0.546 . . . . 74.02 111.808 -178.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.448 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 71.8 m95 -67.46 -17.38 64.67 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.132 -0.485 . . . . 71.13 112.033 -176.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.34 82.55 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.252 -0.499 . . . . 37.66 112.905 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 94' ' ' ARG . 25.4 mmt180 -70.91 -32.49 69.44 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.464 -0.433 . . . . 74.22 111.117 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.3 mm -62.21 -46.29 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.032 0.444 . . . . 72.24 110.546 174.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -57.41 -48.25 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 116.129 -0.487 . . . . 74.33 110.869 174.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.1 m -56.55 -43.27 79.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.247 -0.433 . . . . 73.43 111.654 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.411 HD11 ' SD ' ' A' ' 81' ' ' MET . 33.5 tp -59.3 -55.23 37.51 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.211 0.529 . . . . 72.24 111.652 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.1 mt -68.84 -34.08 62.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.071 -0.513 . . . . 75.33 111.449 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -64.91 -45.17 86.99 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.466 -0.333 . . . . 72.52 111.409 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -62.16 -43.06 99.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.77 0.319 . . . . 75.25 110.651 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -46.45 92.03 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.872 -0.68 . . . . 37.66 112.417 175.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.48 ' HB1' ' HG2' ' A' ' 20' ' ' GLN . . . -66.73 -31.95 72.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.076 0.465 . . . . 65.35 111.951 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.19 -48.44 70.65 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.833 0.349 . . . . 74.04 110.571 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.464 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.9 t -65.44 -36.48 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.884 0.373 . . . . 74.43 110.573 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.34 -43.75 67.95 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.065 -0.516 . . . . 74.22 111.728 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -54.57 -49.54 70.09 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.149 0.5 . . . . 71.1 110.771 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.47 ' O ' HG12 ' A' ' 112' ' ' ILE . 79.1 t60 -60.87 -40.19 92.03 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.037 -0.529 . . . . 74.41 111.36 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 88.2 mt -62.17 -50.46 71.76 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.715 0.293 . . . . 74.45 111.658 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.449 ' HE3' HG21 ' A' ' 22' ' ' THR . 61.0 tttm -62.89 -33.53 75.49 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.201 0.524 . . . . 75.34 111.212 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.9 m -64.14 -45.38 88.77 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.196 -0.456 . . . . 72.33 111.721 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.503 HG13 ' HG2' ' A' ' 114' ' ' GLN . 47.2 pt -90.33 24.64 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 N-CA-C 112.674 0.62 . . . . 74.41 112.674 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 69.28 12.49 8.4 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.848 0.685 . . . . 72.05 112.848 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.503 ' HG2' HG13 ' A' ' 112' ' ' ILE . 13.6 mm100 -99.61 36.99 1.67 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.071 -0.393 . . . . 70.04 111.633 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.89 -32.81 69.84 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.794 0.331 . . . . 71.2 111.492 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.419 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 52.4 m -53.79 -41.42 67.22 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.93 0.395 . . . . 65.4 111.344 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.47 ' HG ' ' HB3' ' A' ' 114' ' ' GLN . 53.1 m -56.9 -27.41 60.68 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.844 0.683 . . . . 74.12 112.844 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 63.9 mt -57.77 -33.55 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 112.203 0.446 . . . . 74.12 112.203 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.79 -54.61 6.15 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 112.481 0.549 . . . . 72.4 112.481 -177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.419 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.5 Cg_endo -59.52 -26.38 81.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.518 1.479 . . . . 72.12 111.799 172.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 109' ' ' LEU . 6.5 tt -66.19 -46.13 78.37 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.661 -0.496 . . . . 74.53 109.661 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.14 -44.58 87.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.252 -0.431 . . . . 75.11 110.802 174.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -58.82 -39.48 81.3 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.4 -0.364 . . . . 71.33 111.176 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -61.67 -41.83 98.09 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.918 0.39 . . . . 62.1 111.006 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 39.7 mm -60.79 -54.1 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-O 121.126 0.489 . . . . 74.53 110.984 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.2 m -68.18 -33.64 74.82 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.104 -0.498 . . . . 72.21 112.084 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.8 t70 -61.03 -52.46 64.9 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.283 -0.261 . . . . 64.54 110.788 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.467 HG22 ' HB2' ' A' ' 81' ' ' MET . 80.4 t -64.51 -39.3 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.141 0.496 . . . . 75.45 110.975 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.522 ' HG ' HD13 ' A' ' 137' ' ' LEU . 45.3 tp -58.93 -53.49 57.8 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.012 -0.54 . . . . 72.43 111.68 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.4 HG12 ' HB2' ' A' ' 134' ' ' ARG . 89.8 t -76.34 -33.79 24.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 111.955 0.354 . . . . 65.22 111.955 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 17.1 tpp180 -53.14 -33.36 52.11 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.246 0.461 . . . . 73.34 112.246 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.49 -28.75 2.04 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.679 0.992 . . . . 65.41 113.679 -175.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -104.31 9.4 35.93 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 112.757 0.651 . . . . 74.24 112.757 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.4 ' HB2' HG12 ' A' ' 130' ' ' VAL . 20.3 ttt180 -50.83 -53.35 32.91 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 121.091 0.472 . . . . 71.52 112.245 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.35 -47.94 74.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 65.31 111.985 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.45 -36.83 85.05 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.279 -0.263 . . . . 74.12 111.463 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.522 HD13 ' HG ' ' A' ' 129' ' ' LEU . 73.3 mt -57.05 -51.0 71.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.75 0.309 . . . . 70.21 111.507 176.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.5 p -77.96 -40.8 27.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 112.512 0.56 . . . . 73.32 112.512 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -63.0 -57.34 11.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.255 0.465 . . . . 72.13 112.255 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -84.88 -3.9 58.88 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.711 0.291 . . . . 75.25 111.324 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 62.29 89.71 0.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.382 0.611 . . . . 63.54 110.535 -173.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . 0.448 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -58.97 -62.24 6.45 Favored Glycine 0 CA--C 1.521 0.438 0 CA-C-N 115.656 -0.702 . . . . 74.0 114.219 -170.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -71.55 -16.6 62.32 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.168 0.433 . . . . 73.32 112.168 -173.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -80.52 -58.08 3.28 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.989 0.423 . . . . 75.04 110.806 173.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.411 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -60.47 -34.78 86.93 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.876 -0.602 . . . . 65.3 113.1 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -54.81 -49.3 71.34 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.963 0.505 . . . . 75.13 111.508 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.66 -42.6 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.173 -0.467 . . . . 72.31 112.222 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.583 ' HA ' ' HB2' ' A' ' 154' ' ' ASP . 12.5 pt-20 -73.34 -27.76 61.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 111.92 0.341 . . . . 75.44 111.92 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -63.69 -45.75 88.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.182 0.515 . . . . 74.45 110.874 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -81.85 3.43 26.08 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.231 -0.441 . . . . 72.51 111.558 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.598 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 2.0 t60 58.91 37.32 24.72 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.065 0.546 . . . . 54.24 112.057 173.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.6 t -71.29 -69.71 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.953 0.406 . . . . 64.41 111.772 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -96.85 -6.75 35.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.579 0.704 . . . . 73.52 110.4 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.598 ' HB3' ' HA ' ' A' ' 151' ' ' HIS . 4.8 t70 -69.44 169.08 13.14 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.965 -1.016 . . . . 50.2 113.371 -175.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.525 ' N ' HD12 ' A' ' 155' ' ' LEU . 0.0 OUTLIER -134.21 -1.62 2.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 112.906 0.706 . . . . 63.15 112.906 179.355 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -140.31 -45.5 0.42 Allowed 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.086 -0.384 . . . . 74.53 111.888 -179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 94.2 126.12 4.45 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.501 -0.38 . . . . 63.45 113.883 176.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -70.28 70.68 0.64 Allowed Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.111 -0.566 . . . . 74.02 111.927 172.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -76.33 -7.97 56.11 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.446 0.536 . . . . 74.04 112.446 -173.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -74.32 121.07 20.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.725 0.298 . . . . 73.34 111.17 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -66.75 -19.52 65.77 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.331 0.493 . . . . 72.24 112.331 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 65.31 22.44 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.521 0.677 . . . . 74.22 111.242 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -74.48 140.04 44.29 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.964 -0.562 . . . . 73.14 111.11 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.5 p80 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 119.294 -0.384 . . . . 73.31 111.22 178.213 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptp . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 120.926 0.393 . . . . 71.01 111.545 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.02 142.01 51.33 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.799 0.666 . . . . 74.11 112.799 -170.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -84.17 165.09 18.72 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.71 -0.677 . . . . 74.21 110.439 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.29 -42.58 91.62 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.684 0.278 . . . . 74.04 110.427 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.92 -40.61 70.04 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.022 0.439 . . . . 65.11 110.975 177.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -67.65 -39.6 84.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.154 -0.475 . . . . 73.23 110.999 176.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -67.65 -51.25 52.19 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.175 0.435 . . . . 63.34 112.175 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.513 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -52.23 -52.04 54.76 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.755 0.312 . . . . 73.13 111.382 175.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.4 p -63.98 -54.63 31.38 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 111.954 0.353 . . . . 60.31 111.954 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.7 tp -52.89 -45.48 67.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.232 0.456 . . . . 72.22 112.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -62.55 -45.46 92.83 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 120.681 0.277 . . . . 73.3 111.248 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 8' ' ' GLN . 86.0 mt -57.63 -51.34 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.243 0.544 . . . . 74.41 111.093 176.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.44 ' O ' HD13 ' A' ' 17' ' ' LEU . 77.8 mt -61.34 -47.87 91.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 115.759 -0.655 . . . . 65.23 111.486 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.432 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 41.8 t -54.35 -50.35 67.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.976 0.417 . . . . 70.41 111.467 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.692 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 35.2 mtp180 -61.33 -48.35 81.7 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.362 -0.381 . . . . 74.2 111.621 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.469 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 32.1 t80 -53.4 -48.78 68.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.879 0.371 . . . . 65.02 111.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.5 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.3 mp -59.61 -42.74 93.33 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.662 0.268 . . . . 73.15 111.421 175.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 14' ' ' SER . 37.2 mmt180 -60.39 -43.9 96.21 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.65 0.262 . . . . 70.13 111.429 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 81.1 mt-10 -63.98 -42.63 97.18 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.009 0.433 . . . . 74.42 111.488 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 27.7 mm-40 -71.99 -26.07 62.09 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.07 0.396 . . . . 75.53 112.07 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.408 ' O ' ' HD3' ' A' ' 110' ' ' LYS . . . -84.82 -44.39 13.31 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.33 0.492 . . . . 64.14 112.33 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -87.62 -30.19 20.65 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.017 0.377 . . . . 75.31 112.017 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.57 -1.58 79.13 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.338 -0.458 . . . . 55.42 112.876 -176.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -94.96 -177.13 4.06 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.056 0.455 . . . . 64.44 111.983 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -117.66 154.93 30.79 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.901 0.381 . . . . 72.31 111.559 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -130.32 106.64 8.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.98 0.419 . . . . 73.33 109.891 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.8 t -103.78 14.59 30.63 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.13 0.418 . . . . 74.32 112.13 -177.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.677 ' HZ3' ' HB2' ' A' ' 28' ' ' LYS . 10.2 mtmp? -76.91 164.0 61.97 Favored Pre-proline 0 CA--C 1.546 0.815 0 N-CA-C 111.656 0.243 . . . . 72.54 111.656 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.56 159.99 7.79 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.626 2.218 . . . . 71.1 112.545 174.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.692 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 25.7 tpp -117.14 -83.43 0.64 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.409 0.522 . . . . 61.42 112.409 -173.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.76 -159.0 10.41 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 121.25 -0.5 . . . . 44.31 113.178 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -83.57 -25.88 30.55 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.977 0.362 . . . . 62.22 111.977 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 87.8 p -58.96 -56.85 16.89 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.873 0.368 . . . . 74.02 111.984 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.22 -110.64 3.4 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.469 -0.396 . . . . 71.45 112.987 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.458 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . . . -54.31 -39.13 66.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.794 0.33 . . . . 74.5 111.576 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.6 m -54.69 -52.33 62.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.06 0.457 . . . . 71.35 111.576 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.558 ' HB2' ' HG2' ' A' ' 30' ' ' MET . 59.6 p -67.36 -31.13 71.17 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.842 0.353 . . . . 64.12 111.856 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 38' ' ' ARG . 1.1 tmm_? -66.49 -53.39 35.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.305 0.574 . . . . 73.32 110.143 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HE2' ' HB3' ' A' ' 35' ' ' ALA . 63.3 mttm -60.95 -39.32 89.04 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.625 -0.716 . . . . 61.03 111.268 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.86 -47.46 82.64 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.409 -0.36 . . . . 74.02 111.706 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.516 HD21 ' HE1' ' A' ' 30' ' ' MET . 57.7 tp -61.38 -52.62 63.86 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 111.846 0.313 . . . . 72.45 111.846 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.97 -39.77 90.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.771 0.319 . . . . 75.4 111.226 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.553 ' O ' HG22 ' A' ' 47' ' ' VAL . 63.7 m -66.15 -50.06 65.26 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.562 0.22 . . . . 62.54 110.818 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.9 mt -53.99 -45.18 71.36 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.258 0.466 . . . . 64.14 112.258 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HA ' ' CE1' ' A' ' 16' ' ' TYR . 5.0 ptm180 -73.97 -39.03 63.98 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 111.784 0.29 . . . . 72.41 111.784 -176.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -71.97 -35.16 69.46 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.296 -0.253 . . . . 74.43 111.679 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.553 HG22 ' O ' ' A' ' 43' ' ' THR . 17.6 m -87.92 -33.47 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.043 0.449 . . . . 64.44 111.366 177.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.43 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -64.3 -42.31 97.85 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-N 116.24 -0.437 . . . . 71.05 113.507 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -54.5 -42.74 71.11 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.912 0.386 . . . . 72.32 111.425 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.6 -43.65 91.64 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.104 -0.569 . . . . 70.3 112.618 176.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.431 ' HA ' HD22 ' A' ' 54' ' ' ASN . 97.3 t -59.62 -41.17 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 120.709 0.29 . . . . 65.21 111.318 177.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 78.9 mt-30 -57.96 -41.42 82.85 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.565 -0.289 . . . . 60.5 111.573 178.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 16.1 mmm-85 -61.98 -56.1 22.62 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.575 0.583 . . . . 71.24 112.575 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.431 HD22 ' HA ' ' A' ' 51' ' ' VAL . 9.6 p30 -70.81 -21.84 62.42 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.031 -0.418 . . . . 51.4 111.785 -177.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -90.46 -20.47 22.7 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.514 0.561 . . . . 73.52 112.514 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -50.08 -49.57 50.95 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.729 0.64 . . . . 72.33 112.729 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -58.93 -34.01 71.24 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.852 0.358 . . . . 75.24 111.859 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.1 -43.83 23.29 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.889 0.376 . . . . 74.34 111.718 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -64.56 -39.65 94.13 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.483 -0.326 . . . . 71.2 111.373 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -53.0 -41.53 64.72 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.0 0.429 . . . . 74.21 110.816 173.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -62.74 -27.0 69.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 115.904 -0.589 . . . . 73.01 112.958 175.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.562 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 81.5 mtp -81.4 -51.42 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 122.637 -0.331 . . . . 74.51 110.97 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.9 mp -55.0 -37.44 66.6 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.542 0.571 . . . . 71.25 112.542 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -66.41 -25.43 66.76 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 111.978 0.362 . . . . 73.11 111.978 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.562 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -96.31 -16.18 21.49 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 122.106 -0.371 . . . . 73.05 110.877 175.422 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.31 -68.26 0.71 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.375 -0.375 . . . . 73.33 111.16 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 54.37 97.71 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.389 0.614 . . . . 63.34 111.938 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.507 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.3 mp -93.1 100.58 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.157 0.503 . . . . 62.51 111.19 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.27 -6.58 17.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.174 -0.466 . . . . 74.14 112.147 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -155.42 174.85 14.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.825 0.345 . . . . 75.14 111.37 177.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.4 -37.37 83.2 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.289 0.477 . . . . 75.3 112.289 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.27 -39.19 66.65 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.788 0.327 . . . . 75.34 111.487 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.478 ' HB2' HG21 ' A' ' 68' ' ' ILE . 48.1 m-20 -63.75 -38.28 90.5 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.066 0.46 . . . . 71.03 110.916 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.38 -46.08 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.337 0.589 . . . . 75.1 110.844 175.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 78' ' ' SER . 98.2 mttt -70.0 -23.93 63.22 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.137 -0.483 . . . . 72.11 111.223 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.2 t -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.074 0.464 . . . . 74.53 110.403 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.518 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.5 mt -57.2 -37.93 72.93 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.345 -0.388 . . . . 62.03 110.464 174.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.446 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 38.5 t -53.25 -37.9 62.51 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.14 -0.482 . . . . 73.15 111.469 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -40.27 97.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.197 0.522 . . . . 74.33 110.54 177.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.448 ' HA ' ' CD2' ' A' ' 83' ' ' HIS . 61.5 t -66.94 -39.79 84.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.072 -0.513 . . . . 64.43 110.647 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.536 ' HB3' HD12 ' A' ' 98' ' ' LEU . 21.4 mmt -55.39 -40.51 71.48 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.864 -0.607 . . . . 73.2 111.211 177.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 78' ' ' SER . 73.7 mt -60.74 -33.55 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 116.078 -0.51 . . . . 75.43 111.349 174.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.448 ' CD2' ' HA ' ' A' ' 80' ' ' VAL . 27.1 m-70 -72.8 -28.86 62.82 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.516 -0.311 . . . . 65.24 111.687 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 92.2 t -58.02 -28.84 34.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 121.064 0.459 . . . . 71.21 111.711 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.482 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 74.0 m-85 -89.85 10.41 23.81 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.853 0.686 . . . . 75.51 112.853 -179.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.1 t -53.57 -33.99 56.75 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.15 0.796 . . . . 75.12 113.15 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.626 ' HB2' ' HD3' ' A' ' 94' ' ' ARG . 6.7 m-20 -55.13 -38.11 67.79 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.712 0.634 . . . . 64.3 112.712 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.28 -50.38 3.43 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 120.919 -0.658 . . . . 62.03 113.339 -177.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.409 ' O ' ' NH2' ' A' ' 94' ' ' ARG . 60.9 t -48.56 134.6 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 112.498 0.555 . . . . 74.41 112.498 -178.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.427 ' O ' HG23 ' A' ' 90' ' ' THR . 8.1 t -67.66 86.1 0.2 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 122.003 0.906 . . . . 54.14 112.441 -177.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -134.08 116.49 15.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.627 -0.715 . . . . 72.32 110.83 175.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.48 ' HE3' HG13 ' A' ' 95' ' ' ILE . 81.8 m95 -63.81 -7.2 7.21 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.525 0.565 . . . . 75.35 112.525 -175.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.1 -31.59 73.42 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.189 -0.529 . . . . 71.1 112.786 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.626 ' HD3' ' HB2' ' A' ' 87' ' ' ASP . 65.8 mtm180 -66.23 -36.2 82.39 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.393 -0.475 . . . . 71.41 111.188 175.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.48 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.4 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.134 0.492 . . . . 74.2 110.501 176.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.19 -49.91 81.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.115 -0.493 . . . . 60.35 111.178 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.8 m -56.01 -41.96 75.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.39 -0.368 . . . . 75.34 111.473 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.536 HD12 ' HB3' ' A' ' 81' ' ' MET . 35.9 tp -61.33 -55.1 35.45 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.27 0.557 . . . . 74.44 111.896 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.0 mt -72.04 -35.26 53.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 116.14 -0.482 . . . . 73.53 111.955 -174.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.2 p -64.7 -44.89 88.81 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.581 0.229 . . . . 63.33 111.044 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -60.26 -41.32 93.01 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.797 0.332 . . . . 74.33 110.991 176.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.71 -43.83 94.33 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.858 -0.686 . . . . 62.44 112.468 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.5 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.14 -35.18 79.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.981 0.42 . . . . 74.22 111.439 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -62.44 -42.61 99.59 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.229 -0.441 . . . . 75.24 111.018 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.428 ' HB ' HD12 ' A' ' 121' ' ' LEU . 47.3 t -71.46 -38.3 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.737 0.303 . . . . 73.14 110.863 175.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.97 73.33 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.345 0.498 . . . . 55.13 112.345 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 19.4 ptpt -61.43 -36.16 79.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.111 0.481 . . . . 72.44 110.925 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -68.58 -34.72 76.3 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.376 -0.375 . . . . 74.04 110.89 176.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.472 HD13 HD11 ' A' ' 121' ' ' LEU . 90.0 mt -62.63 -50.36 71.55 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.639 0.257 . . . . 63.22 111.073 177.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 56.6 tttm -61.74 -35.14 77.23 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.905 0.383 . . . . 74.4 111.041 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.2 m -60.48 -41.14 93.62 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.414 -0.357 . . . . 73.54 111.491 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.4 pt -92.94 18.88 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.864 0.364 . . . . 74.11 111.876 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 67.59 16.21 9.85 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.182 0.808 . . . . 73.41 113.182 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.502 ' HB3' ' HG ' ' A' ' 117' ' ' SER . 14.9 mm100 -91.95 40.84 1.05 Allowed 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.96 0.409 . . . . 73.23 110.795 173.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.98 -40.8 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.017 0.527 . . . . 71.34 111.812 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 88.3 p -62.94 -33.59 75.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.027 0.38 . . . . 75.31 112.027 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.502 ' HG ' ' HB3' ' A' ' 114' ' ' GLN . 49.4 m -58.24 -26.11 62.5 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.353 0.501 . . . . 72.41 112.353 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 70.0 mt -54.38 -36.03 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 112.295 0.48 . . . . 62.43 112.295 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -67.08 -58.3 9.45 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 112.331 0.493 . . . . 73.42 112.331 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -57.32 -28.68 81.04 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.634 1.556 . . . . 50.14 112.092 175.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.472 HD11 HD13 ' A' ' 109' ' ' LEU . 5.0 tt -64.41 -50.45 67.55 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 110.008 -0.368 . . . . 72.11 110.008 175.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.28 76.21 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.174 0.511 . . . . 63.44 111.137 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.77 -29.19 67.52 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.325 -0.398 . . . . 71.02 111.594 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.0 m -69.34 -43.52 73.51 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.843 0.354 . . . . 74.31 111.089 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.426 HG22 ' HG ' ' A' ' 98' ' ' LEU . 44.6 mm -55.73 -52.92 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.367 0.603 . . . . 65.22 110.43 174.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.4 m -65.43 -35.97 82.52 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.419 -0.81 . . . . 74.44 111.666 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.9 t70 -57.53 -52.54 64.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.733 0.302 . . . . 74.53 110.996 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.541 ' O ' HG23 ' A' ' 132' ' ' THR . 62.1 t -64.36 -42.8 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 120.937 0.399 . . . . 73.1 111.053 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.523 ' HG ' HD13 ' A' ' 137' ' ' LEU . 44.1 tp -53.89 -52.84 59.24 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.335 0.588 . . . . 73.0 111.351 178.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.76 -30.74 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.856 -0.611 . . . . 72.32 111.376 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.1 tpt180 -57.47 -49.69 75.47 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.121 0.486 . . . . 64.14 112.179 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.541 HG23 ' O ' ' A' ' 128' ' ' VAL . 2.9 t -104.39 -29.56 10.66 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.906 1.076 . . . . 70.52 113.906 -172.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -130.47 22.44 5.13 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.081 1.141 . . . . 74.5 114.081 -171.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.493 ' HA ' HD12 ' A' ' 137' ' ' LEU . 33.8 ttp180 -54.47 -43.35 71.64 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-O 121.011 0.434 . . . . 71.13 111.983 175.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.405 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 33.8 t70 -58.65 -49.58 77.0 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.21 -0.45 . . . . 65.31 111.525 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.46 -35.74 81.82 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.774 0.287 . . . . 72.42 111.774 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.523 HD13 ' HG ' ' A' ' 129' ' ' LEU . 55.9 mt -51.81 -48.45 63.87 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.661 0.267 . . . . 72.32 111.501 174.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.79 -31.85 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 112.446 0.536 . . . . 63.14 112.446 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 45.1 mmtm -65.47 -64.33 0.89 Allowed 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.965 -0.46 . . . . 71.33 112.186 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -85.6 4.02 38.11 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.419 -0.355 . . . . 75.25 111.247 -176.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 51.49 72.17 0.39 Allowed 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.231 0.539 . . . . 72.23 110.084 -172.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.33 -50.29 6.63 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.218 -0.901 . . . . 70.01 114.793 -171.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.437 ' O ' HG22 ' A' ' 147' ' ' VAL . 40.5 m95 -72.95 -26.26 61.32 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.32 0.489 . . . . 74.53 112.32 -175.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -76.42 -53.93 7.45 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.279 0.562 . . . . 72.24 110.587 173.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.444 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -58.39 -33.64 71.82 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.716 -0.675 . . . . 71.41 112.673 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.56 -45.71 81.13 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.301 0.572 . . . . 74.43 111.58 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.489 HG13 ' HB ' ' A' ' 152' ' ' VAL . 47.2 t -70.26 -42.34 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.941 -0.572 . . . . 65.12 112.026 -177.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.444 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.8 pt-20 -73.34 -27.89 61.76 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.783 0.325 . . . . 74.41 111.36 177.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.4 ' HE1' ' HD2' ' A' ' 163' ' ' HIS . 82.0 t80 -61.89 -48.96 78.16 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.575 0.35 . . . . 71.45 111.675 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -83.21 -10.99 58.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 111.961 0.356 . . . . 71.45 111.961 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.424 ' CG ' ' HA3' ' A' ' 158' ' ' GLY . 22.2 t-160 65.75 74.83 0.36 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.197 0.522 . . . . 72.14 111.405 -177.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.489 ' HB ' HG13 ' A' ' 147' ' ' VAL . 59.9 t -111.17 -68.77 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 74.12 110.158 174.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.444 ' HG3' HG12 ' A' ' 152' ' ' VAL . 65.7 mt-10 -137.84 84.76 2.06 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.096 0.474 . . . . 75.5 111.228 174.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -102.62 -164.68 1.11 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.117 -0.492 . . . . 73.51 110.516 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.515 HD21 ' HG3' ' A' ' 156' ' ' GLU . 0.0 OUTLIER -124.83 11.96 8.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.28 0.474 . . . . 74.11 112.28 -178.033 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.515 ' HG3' HD21 ' A' ' 155' ' ' LEU . 43.9 mt-10 -115.99 -71.58 0.73 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.341 0.591 . . . . 74.12 111.155 177.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 170.83 26.36 0.02 OUTLIER Glycine 0 CA--C 1.527 0.781 0 CA-C-N 115.615 -0.72 . . . . 73.52 112.51 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . 0.424 ' HA3' ' CG ' ' A' ' 151' ' ' HIS . . . 75.94 148.36 2.24 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 113.951 0.341 . . . . 73.13 113.951 -176.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -72.37 141.4 48.75 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.931 0.396 . . . . 73.13 110.727 175.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -76.23 -37.67 57.4 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.422 -0.354 . . . . 74.23 111.687 -175.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -138.54 135.7 35.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.786 0.326 . . . . 74.42 111.026 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -84.07 71.45 10.55 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.745 0.307 . . . . 72.34 111.099 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.4 ' HD2' ' HE1' ' A' ' 149' ' ' PHE . 67.9 m-70 58.0 12.44 1.8 Allowed 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.844 0.354 . . . . 71.44 111.884 -173.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.361 -0.828 . . . . 72.3 110.595 -178.995 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.724 0.297 . . . . 72.31 111.5 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.91 148.43 27.68 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.172 0.51 . . . . 75.52 112.087 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -89.79 156.75 18.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 116.042 -0.526 . . . . 72.45 110.668 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -55.52 -41.58 73.31 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.891 0.377 . . . . 53.33 111.305 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' A' ' 137' ' ' LEU . 66.6 tp -55.93 -46.79 78.37 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.045 -0.525 . . . . 74.12 110.9 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -62.72 -43.26 99.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.155 -0.475 . . . . 73.0 110.879 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -58.47 -44.63 89.38 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.341 0.497 . . . . 52.11 112.341 177.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.439 ' O ' HG13 ' A' ' 12' ' ' ILE . 47.7 tt0 -73.15 -45.03 59.03 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.707 0.262 . . . . 61.34 111.707 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.0 p -60.91 -53.1 61.45 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.695 0.283 . . . . 62.24 111.148 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.9 tp -54.53 -40.83 69.03 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.379 -0.373 . . . . 65.0 111.559 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.529 ' HG2' ' HA2' ' A' ' 31' ' ' GLY . 9.8 tp10 -57.39 -51.64 68.6 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.132 0.491 . . . . 65.01 111.317 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.51 ' HA ' ' HE1' ' A' ' 30' ' ' MET . 57.2 mt -64.21 -49.75 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.043 -0.526 . . . . 74.11 111.37 -178.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 86.0 mt -62.32 -47.29 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 116.224 -0.444 . . . . 72.03 111.662 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.524 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 39.3 t -54.66 -54.6 39.57 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.512 -0.313 . . . . 73.43 111.642 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.448 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 71.0 mtp180 -60.27 -45.84 91.89 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.666 -0.243 . . . . 73.25 111.499 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -56.12 -48.54 76.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.884 0.373 . . . . 72.23 111.555 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.489 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.1 mp -59.39 -41.89 90.44 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.741 -0.209 . . . . 73.44 111.452 176.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.524 ' HG2' ' O ' ' A' ' 14' ' ' SER . 22.1 mmm180 -63.79 -55.36 23.64 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 111.688 0.255 . . . . 73.41 111.688 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.422 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 6.9 pt-20 -61.62 -40.6 95.43 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.015 0.376 . . . . 74.2 112.015 -177.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.7 mm-40 -70.66 -22.74 62.46 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.161 -0.337 . . . . 74.52 111.439 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -80.04 -43.06 22.55 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 111.88 0.326 . . . . 75.32 111.88 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.5 p -87.4 -16.83 33.78 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.924 0.392 . . . . 70.31 111.662 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.91 7.79 88.17 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 121.105 -0.569 . . . . 74.11 112.527 -176.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.95 141.4 38.43 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.482 . . . . 64.54 111.581 -177.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.9 mtpt -80.83 156.13 26.27 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.016 -0.538 . . . . 75.33 111.8 -177.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -101.59 -172.48 2.16 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.673 0.273 . . . . 71.13 110.743 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.2 t -143.27 48.55 1.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.741 . . . . 62.52 112.294 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -87.99 160.56 46.16 Favored Pre-proline 0 N--CA 1.477 0.918 0 O-C-N 122.035 -0.416 . . . . 72.13 112.026 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -64.41 118.17 5.16 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.338 2.025 . . . . 75.11 111.308 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.51 ' HE1' ' HA ' ' A' ' 12' ' ' ILE . 13.6 tpt -83.23 106.64 15.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.442 1.275 . . . . 74.41 114.442 -164.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.529 ' HA2' ' HG2' ' A' ' 11' ' ' GLU . . . 67.12 179.43 12.04 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 115.853 1.101 . . . . 61.44 115.853 167.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.02 -40.63 16.65 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.225 -0.487 . . . . 62.02 110.89 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.9 t -72.87 -28.21 62.37 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 116.212 -0.449 . . . . 70.03 111.752 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.96 -97.42 1.97 Allowed Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.064 -0.589 . . . . 52.12 113.164 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.38 -49.67 75.44 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.183 0.438 . . . . 73.44 112.183 -176.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.4 m -60.47 -41.06 93.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.092 0.472 . . . . 64.12 111.107 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.3 m -62.99 -42.39 99.83 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.273 -0.422 . . . . 74.34 111.15 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -63.55 -55.95 19.79 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.888 0.375 . . . . 71.53 111.572 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.578 ' HG3' HG21 ' A' ' 147' ' ' VAL . 3.2 ptmm? -63.18 -29.36 70.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.34 -0.391 . . . . 73.21 111.404 -174.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.16 82.36 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.929 0.395 . . . . 74.01 111.06 173.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.507 ' HB2' ' HE3' ' A' ' 30' ' ' MET . 63.2 tp -59.22 -54.39 47.43 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.306 -0.407 . . . . 71.32 111.92 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.37 -24.79 64.83 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.025 0.379 . . . . 75.52 112.025 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.472 HG23 HG23 ' A' ' 152' ' ' VAL . 28.3 m -66.49 -42.52 87.28 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 122.106 -0.371 . . . . 75.45 110.3 169.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.4 mt -56.41 -31.89 64.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.691 0.282 . . . . 70.01 111.513 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -68.76 -54.45 15.94 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.289 0.566 . . . . 61.13 110.68 174.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 24.3 ttt180 -56.46 -44.84 80.91 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.287 -0.869 . . . . 70.13 112.416 -177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 43' ' ' THR . 15.6 m -93.72 -33.08 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.179 0.437 . . . . 74.01 112.179 -178.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.438 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.63 -49.52 59.52 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.229 -0.51 . . . . 65.44 113.602 -174.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 14.8 t70 -61.57 -35.99 79.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 117.223 0.512 . . . . 64.31 110.751 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.9 -50.15 70.83 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 121.075 -0.583 . . . . 75.03 112.089 174.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.427 ' HA ' HD22 ' A' ' 54' ' ' ASN . 86.8 t -58.23 -38.46 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.831 0.348 . . . . 74.12 111.192 176.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.4 mt-30 -57.01 -50.56 72.34 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.616 -0.265 . . . . 73.31 111.2 175.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 15.2 mmp_? -55.26 -50.18 70.14 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.904 0.705 . . . . 73.22 112.904 -175.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.427 HD22 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -78.39 -23.1 46.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 112.59 0.589 . . . . 71.42 112.59 -177.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -91.68 -16.96 26.2 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.629 0.603 . . . . 72.1 112.629 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -48.61 -57.95 5.44 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.508 0.929 . . . . 74.03 113.508 -167.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -62.49 -31.36 72.09 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.08 0.466 . . . . 64.11 111.523 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.41 -30.5 67.4 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.988 0.423 . . . . 61.34 111.216 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -76.98 -43.04 36.46 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.422 -0.354 . . . . 72.42 111.224 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -52.05 -40.0 60.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.825 0.345 . . . . 64.12 111.49 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.94 -33.36 56.8 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 121.4 -0.429 . . . . 72.55 113.603 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 67.0 mtm -91.0 -37.29 13.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.494 0.664 . . . . 71.25 110.44 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -63.44 -38.08 89.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.483 -0.78 . . . . 72.53 111.786 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.72 -39.8 74.55 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.232 -0.44 . . . . 73.05 112.183 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -2.62 58.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.833 0.349 . . . . 74.13 111.636 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.09 -75.7 0.51 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.94 0.4 . . . . 75.01 110.99 174.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 43.34 83.37 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.48 -0.782 . . . . 74.34 111.063 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.567 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.6 mp -60.31 113.61 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.716 -0.675 . . . . 72.51 112.031 -172.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.32 -8.98 18.86 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.986 -0.552 . . . . 61.34 112.155 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.415 HD21 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -166.35 179.75 5.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.911 0.386 . . . . 64.23 111.759 173.721 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -53.63 -38.8 64.41 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.563 0.579 . . . . 71.1 112.563 -178.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.16 -39.21 63.41 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.825 0.345 . . . . 64.02 111.79 -178.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.522 ' HB2' HG21 ' A' ' 68' ' ' ILE . 21.7 m-20 -69.26 -34.47 74.82 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.947 0.404 . . . . 73.14 110.812 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.55 -39.58 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.271 0.557 . . . . 75.31 110.324 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -62.95 -38.83 92.66 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.174 0.511 . . . . 74.44 110.451 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 45.7 t -62.86 -34.14 76.75 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.095 -0.502 . . . . 62.52 111.33 174.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.485 HD12 HG13 ' A' ' 105' ' ' VAL . 90.4 mt -62.48 -40.01 95.32 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.734 0.302 . . . . 71.24 111.024 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.5 t -52.53 -38.54 59.89 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.176 0.513 . . . . 71.23 111.194 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -58.09 -41.03 82.6 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.051 -0.522 . . . . 73.31 110.894 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.06 -41.29 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 120.951 0.405 . . . . 63.2 110.725 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.2 mmt -54.7 -40.68 69.41 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.992 -0.549 . . . . 73.0 111.241 178.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.31 -32.67 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-O 121.085 0.469 . . . . 71.51 111.313 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -74.31 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 111.829 0.307 . . . . 61.52 111.829 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 67.9 t -57.66 -43.01 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.091 0.472 . . . . 71.34 111.342 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.486 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.2 m-85 -82.5 44.05 0.86 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.033 0.444 . . . . 73.52 111.963 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.7 t -71.51 -0.85 11.47 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.446 0.536 . . . . 74.21 112.446 -178.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -147.01 -174.62 4.54 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.977 0.418 . . . . 64.02 111.664 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.19 56.67 0.61 Allowed Glycine 0 CA--C 1.527 0.842 0 C-N-CA 120.936 -0.65 . . . . 62.14 113.799 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.475 HG21 ' H ' ' A' ' 91' ' ' ASN . 15.0 p -73.29 147.76 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 116.931 0.365 . . . . 70.23 111.278 176.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 75.1 p -69.76 -6.61 33.24 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.425 0.528 . . . . 75.21 112.425 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.475 ' H ' HG21 ' A' ' 89' ' ' VAL . 79.9 m-20 -77.93 150.85 33.96 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.083 0.468 . . . . 72.05 111.592 177.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.473 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.6 m95 -93.69 -2.68 53.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.423 0.527 . . . . 72.54 112.423 -177.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.36 -35.78 51.46 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.239 -0.505 . . . . 62.04 113.05 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -56.65 -43.05 79.94 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.942 0.401 . . . . 75.32 111.592 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.473 HG13 ' HE3' ' A' ' 92' ' ' TRP . 43.9 mm -66.68 -43.29 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-O 121.078 0.465 . . . . 72.21 110.322 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.9 t -57.38 -42.32 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.026 -0.534 . . . . 72.04 110.595 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.3 m -57.4 -46.76 83.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 72.42 111.417 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.491 ' HG ' HG22 ' A' ' 125' ' ' ILE . 31.2 tp -58.35 -54.52 46.07 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.142 0.496 . . . . 70.32 111.381 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.2 mt -65.53 -37.96 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.055 -0.52 . . . . 74.03 111.959 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.4 m -63.19 -45.82 89.94 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 116.565 -0.289 . . . . 71.3 111.355 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -65.49 -39.5 91.97 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 120.768 0.318 . . . . 75.54 110.863 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.87 -47.93 85.58 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.962 -0.637 . . . . 54.4 112.377 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.489 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.35 -32.29 73.6 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.854 0.359 . . . . 75.44 111.341 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.436 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 39.0 t80 -63.51 -42.84 98.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.081 0.467 . . . . 53.11 111.12 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.485 HG13 HD12 ' A' ' 77' ' ' LEU . 45.5 t -72.2 -40.47 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.932 0.396 . . . . 72.3 110.674 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.473 ' HB3' HG21 ' A' ' 118' ' ' ILE . . . -58.3 -45.3 88.26 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.139 -0.482 . . . . 74.44 112.291 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 17.1 ptmt -64.12 -32.94 74.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.783 0.325 . . . . 71.3 111.031 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.31 -34.24 75.77 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.748 0.309 . . . . 72.21 110.553 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.567 HD21 ' HB ' ' A' ' 68' ' ' ILE . 92.9 mt -61.82 -49.23 77.12 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.747 0.308 . . . . 72.45 111.148 176.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 8.5 tmtm? -54.29 -44.3 71.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 110.066 -0.346 . . . . 74.33 110.066 176.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.7 m -52.67 -50.53 63.08 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.223 -0.444 . . . . 65.44 111.863 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 38.6 pt -87.29 15.78 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 68.51 18.29 8.95 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.938 0.718 . . . . 73.24 112.938 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -91.66 43.27 1.13 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.011 0.434 . . . . 71.01 111.265 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.91 -17.54 61.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.078 0.399 . . . . 64.41 112.078 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.421 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 72.2 p -71.48 -48.3 50.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.91 0.386 . . . . 73.51 111.012 173.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.45 ' HB2' HD12 ' A' ' 109' ' ' LEU . 24.5 m -56.7 -28.23 60.47 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.061 -0.518 . . . . 73.53 111.991 -177.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.473 HG21 ' HB3' ' A' ' 106' ' ' ALA . 70.9 mt -55.45 -40.95 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 112.639 0.607 . . . . 71.15 112.639 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.06 -53.95 22.75 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 112.203 0.445 . . . . 63.22 112.203 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.421 ' HD2' ' O ' ' A' ' 116' ' ' SER . 23.5 Cg_endo -62.02 -25.04 77.31 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 121.579 1.519 . . . . 64.24 112.438 173.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.422 HD12 HD11 ' A' ' 109' ' ' LEU . 3.9 tt -61.25 -46.48 90.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.698 -0.482 . . . . 74.01 109.698 174.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.05 -33.75 65.28 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.052 0.453 . . . . 64.53 111.439 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -68.18 -39.44 82.51 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.198 -0.455 . . . . 74.42 111.914 177.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 98.3 p -63.35 -47.48 81.95 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.815 0.28 . . . . 63.31 111.099 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.491 HG22 ' HG ' ' A' ' 98' ' ' LEU . 45.9 mm -52.86 -53.23 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.384 0.611 . . . . 74.21 111.028 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.8 m -66.67 -35.83 81.09 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.671 -0.695 . . . . 71.32 111.612 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.6 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 33.3 t70 -61.0 -53.0 62.63 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.755 -0.202 . . . . 72.55 110.912 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.75 -41.42 92.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 120.95 0.405 . . . . 72.53 111.097 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.565 ' HG ' HD13 ' A' ' 137' ' ' LEU . 24.8 tp -52.9 -52.52 57.28 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.284 0.564 . . . . 61.01 111.036 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 89.2 t -74.16 -35.22 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.97 -0.559 . . . . 55.14 111.576 177.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.6 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.1 ttt180 -54.83 -32.8 60.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.114 0.566 . . . . 73.13 112.106 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.706 HG23 ' HD2' ' A' ' 133' ' ' LYS . 1.6 t -127.1 -18.97 4.46 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 74.43 113.765 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.706 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.3 mptp? -123.68 20.95 9.34 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.17 0.804 . . . . 74.43 113.17 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -45.66 -64.11 0.81 Allowed 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.228 0.537 . . . . 72.11 112.424 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.12 -40.24 93.04 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.742 -0.663 . . . . 73.5 111.826 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -60.04 -42.07 93.62 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 122.239 -0.288 . . . . 71.11 111.61 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.565 HD13 ' HG ' ' A' ' 129' ' ' LEU . 83.3 mt -53.18 -52.53 58.54 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.942 0.401 . . . . 75.21 111.523 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.13 -38.33 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 112.326 0.491 . . . . 53.41 112.326 -176.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -65.11 -40.99 95.3 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.22 0.452 . . . . 70.12 112.22 -177.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -89.76 0.94 56.69 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.352 -0.217 . . . . 74.04 111.576 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 55.16 74.06 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.614 0.721 . . . . 65.42 110.07 -173.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . 0.422 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -53.47 -68.58 1.56 Allowed Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.97 -1.014 . . . . 44.23 115.173 -168.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -67.16 -12.42 59.97 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.156 0.428 . . . . 74.1 112.156 -173.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -84.42 -58.37 2.77 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.993 0.425 . . . . 71.35 110.566 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.541 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -62.58 -30.27 76.12 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.029 -0.532 . . . . 72.42 113.053 178.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -53.96 -47.7 71.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.338 0.589 . . . . 63.01 111.474 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.578 HG21 ' HG3' ' A' ' 39' ' ' LYS . 24.3 t -73.79 -39.46 52.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.867 -0.606 . . . . 71.44 112.293 -174.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.584 ' HB2' ' HA3' ' A' ' 157' ' ' GLY . 9.2 pt-20 -66.91 -38.65 86.62 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.825 0.345 . . . . 70.33 110.677 176.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.424 ' N ' ' HG3' ' A' ' 148' ' ' GLU . 84.3 t80 -53.69 -48.02 69.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.286 -0.416 . . . . 64.11 111.716 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -82.41 -5.47 58.67 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.791 0.329 . . . . 73.33 111.634 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 59.31 26.41 15.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.375 0.67 . . . . 73.41 112.373 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.472 HG23 HG23 ' A' ' 43' ' ' THR . 96.7 t -57.6 -44.27 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.023 0.44 . . . . 73.02 112.053 -176.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.18 -45.29 1.02 Allowed 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.304 0.573 . . . . 75.31 110.563 176.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.96 67.03 6.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.406 0.622 . . . . 73.03 111.546 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.427 HD23 ' N ' ' A' ' 156' ' ' GLU . 0.0 OUTLIER -61.36 -26.06 67.58 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.048 -0.523 . . . . 55.14 112.015 -179.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.427 ' N ' HD23 ' A' ' 155' ' ' LEU . 10.4 pt-20 -66.89 -14.88 63.22 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.871 0.323 . . . . 74.52 111.871 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . 0.584 ' HA3' ' HB2' ' A' ' 148' ' ' GLU . . . -91.88 97.85 2.35 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 121.299 -0.477 . . . . 70.04 112.276 175.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -128.22 49.38 0.93 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.07 -0.586 . . . . 62.01 113.096 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -74.24 88.69 2.01 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 122.322 -0.516 . . . . 72.13 111.988 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -78.16 156.92 29.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.947 0.403 . . . . 73.15 111.553 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -136.97 111.11 8.34 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.772 0.32 . . . . 74.54 111.835 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -159.63 112.92 2.22 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.93 0.395 . . . . 74.51 111.161 173.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -93.8 160.97 14.51 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.255 -0.43 . . . . 74.02 111.311 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.8 p80 . . . . . 0 C--O 1.252 1.211 0 CA-C-N 116.317 -0.401 . . . . 72.53 111.676 -179.345 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.9 mmm . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.962 0.41 . . . . 63.11 110.464 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.11 -165.85 1.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.134 0.492 . . . . 73.53 111.741 -171.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -101.87 156.24 17.64 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.174 -0.466 . . . . 74.34 110.985 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -54.28 -43.88 71.43 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.14 0.495 . . . . 65.34 111.245 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.549 HD23 ' HB2' ' A' ' 137' ' ' LEU . 65.2 tp -59.75 -34.91 73.58 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.839 -0.618 . . . . 73.02 111.437 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -66.65 -46.03 77.06 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.37 -0.377 . . . . 65.34 110.331 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -60.75 -43.64 97.7 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.972 0.415 . . . . 75.15 111.22 177.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.467 ' OE1' ' HB2' ' A' ' 32' ' ' ARG . 7.1 tp60 -56.17 -53.71 53.91 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.343 0.592 . . . . 71.34 111.131 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.3 m -64.98 -43.78 91.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.659 -0.7 . . . . 55.44 111.495 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.78 -44.69 93.78 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.555 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.463 ' HG3' ' HE2' ' A' ' 30' ' ' MET . 5.6 tp10 -57.35 -51.35 69.77 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.263 0.554 . . . . 74.03 111.193 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.433 HG23 ' HB2' ' A' ' 41' ' ' LEU . 68.1 mt -59.85 -54.06 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.93 -0.577 . . . . 74.24 111.6 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.469 HD12 HG23 ' A' ' 125' ' ' ILE . 81.1 mt -61.99 -42.26 94.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 116.132 -0.485 . . . . 72.42 111.822 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.8 t -55.07 -53.88 50.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.89 0.376 . . . . 71.13 111.836 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.69 -39.15 93.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.552 -0.295 . . . . 64.42 111.511 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.46 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 57.0 t80 -59.85 -49.06 79.19 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.09 0.471 . . . . 71.11 111.489 178.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.0 mp -62.71 -38.13 89.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.765 0.317 . . . . 73.32 111.211 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -65.73 -43.31 89.41 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.011 0.375 . . . . 62.45 112.011 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 3.2 pt-20 -69.49 -39.65 77.51 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.109 -0.369 . . . . 74.3 111.571 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.501 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.6 mm-40 -71.43 -28.08 63.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.788 0.328 . . . . 74.02 111.397 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.57 -41.87 44.83 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 111.872 0.323 . . . . 62.2 111.872 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.3 p -88.27 -29.97 20.0 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.032 0.444 . . . . 64.44 112.184 -178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.87 12.21 59.42 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.427 -0.416 . . . . 42.31 112.398 -174.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -143.08 127.17 17.44 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.736 0.303 . . . . 61.32 111.588 -178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.95 162.26 13.09 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.859 0.362 . . . . 74.52 111.133 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -112.71 -175.33 2.65 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.354 0.597 . . . . 71.32 111.916 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.1 t -141.71 23.98 2.07 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.773 -0.649 . . . . 74.35 110.135 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.409 ' HB2' ' HE3' ' A' ' 28' ' ' LYS . 42.1 mtmt -64.65 154.24 85.4 Favored Pre-proline 0 N--CA 1.467 0.422 0 CA-C-N 115.698 -0.683 . . . . 64.43 111.253 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -49.44 126.94 16.96 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.615 2.21 . . . . 73.11 112.257 177.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.463 ' HE2' ' HG3' ' A' ' 11' ' ' GLU . 3.6 tpt -78.07 148.7 34.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.656 -0.247 . . . . 64.5 111.422 -173.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -50.01 -76.51 0.16 Allowed Glycine 0 CA--C 1.531 1.069 0 N-CA-C 115.243 0.857 . . . . 42.31 115.243 -175.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.467 ' HB2' ' OE1' ' A' ' 8' ' ' GLN . 4.8 mmp_? -86.77 -82.08 0.21 Allowed 'General case' 0 CA--C 1.543 0.686 0 O-C-N 122.327 -0.514 . . . . 74.25 112.009 -176.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.9 m -81.22 177.64 8.88 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 120.893 0.378 . . . . 73.0 111.887 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -109.84 -76.14 0.87 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.262 -0.494 . . . . 37.79 112.797 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.33 68.44 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.152 0.427 . . . . 75.22 112.152 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.584 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . 59.8 m -59.53 -52.04 67.26 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.276 0.472 . . . . 75.35 112.276 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.9 p -61.05 -45.48 94.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.296 -0.411 . . . . 75.05 111.461 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -46.27 81.7 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 111.864 0.32 . . . . 75.02 111.864 179.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.635 ' HB2' ' HB2' ' A' ' 153' ' ' GLU . 24.2 pttm -67.17 -28.8 68.41 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.088 -0.382 . . . . 73.15 111.62 -178.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.32 -51.92 64.01 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.925 0.393 . . . . 74.42 110.498 173.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.433 ' HB2' HG23 ' A' ' 12' ' ' ILE . 65.5 tp -59.01 -44.85 91.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.31 0.576 . . . . 72.51 111.208 175.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.37 -41.2 88.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.781 -0.645 . . . . 74.25 111.161 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.1 m -72.1 -38.35 69.35 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.315 -0.402 . . . . 54.32 111.02 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.0 mt -53.64 -47.05 70.68 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 111.944 0.35 . . . . 72.21 111.944 177.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -74.14 -29.78 61.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.774 0.321 . . . . 74.31 111.42 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -63.45 -45.1 92.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.796 0.331 . . . . 72.31 111.396 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.84 -30.4 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.028 0.442 . . . . 73.43 111.468 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.39 -44.39 97.65 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.921 -0.582 . . . . 61.04 112.953 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.644 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 23.1 t70 -50.84 -57.37 8.62 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.837 0.351 . . . . 64.21 110.955 176.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.07 -45.13 92.75 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.399 -0.429 . . . . 45.44 113.548 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 85.1 t -62.92 -42.62 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.883 0.373 . . . . 74.12 111.508 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 27.8 mt-30 -66.74 -27.5 67.66 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.024 0.379 . . . . 75.54 112.024 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 21.6 mmt180 -64.07 -42.84 96.84 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.389 . . . . 73.51 111.193 175.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -84.05 -49.82 8.55 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.117 0.484 . . . . 72.33 112.272 -176.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -75.06 -20.99 59.29 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.317 0.858 . . . . 72.22 113.317 -172.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 52' ' ' GLN . 42.7 tt0 -50.49 -52.51 37.66 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.102 0.408 . . . . 74.41 112.102 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -55.69 -36.96 67.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.962 0.41 . . . . 73.22 111.824 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.32 62.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.916 0.389 . . . . 74.21 111.565 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -66.17 -37.94 86.84 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.545 -0.298 . . . . 74.22 111.507 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.608 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 79.4 mm-40 -48.86 -49.49 39.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 74.52 111.175 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -32.28 52.93 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.242 -0.436 . . . . 53.11 113.689 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.409 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 46.2 mtm -89.37 -30.22 18.54 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.241 0.543 . . . . 73.22 110.356 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.8 tp -63.04 -30.78 71.87 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 65.13 111.021 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 61.6 mtp180 -68.24 -16.55 64.01 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.934 -0.576 . . . . 72.14 112.222 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.37 5.85 23.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.001 0.429 . . . . 72.04 111.332 176.104 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 98.5 mt -103.85 -73.72 0.66 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.292 -0.413 . . . . 75.23 111.226 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 38.26 87.06 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.125 0.787 . . . . 74.2 113.125 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.52 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -65.92 113.5 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.401 -0.818 . . . . 75.45 112.065 -176.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.475 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -99.91 -6.03 27.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.375 -0.375 . . . . 53.43 111.641 177.581 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.539 HD22 ' HB3' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -173.36 174.62 3.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 120.932 0.396 . . . . 72.35 111.644 172.009 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -50.84 -30.48 14.52 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.493 0.553 . . . . 73.42 112.493 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.539 ' HB3' HD22 ' A' ' 70' ' ' ASN . 29.8 t70 -52.99 -41.75 64.9 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.122 0.487 . . . . 71.34 111.444 176.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.52 ' HB2' HG21 ' A' ' 68' ' ' ILE . 17.4 m-20 -73.18 -28.42 62.2 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.301 -0.409 . . . . 65.01 111.122 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -62.19 -40.92 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.299 0.571 . . . . 74.23 110.386 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.99 -30.72 70.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.042 -0.526 . . . . 74.34 110.851 174.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.5 t -66.06 -37.63 86.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.181 0.515 . . . . 73.32 110.529 171.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.4 mt -62.13 -38.11 87.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.225 -0.443 . . . . 70.53 110.873 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.8 t -52.74 -41.02 63.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.983 0.42 . . . . 72.31 111.198 177.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -55.5 -47.24 76.5 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.752 175.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.61 -41.79 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.969 0.414 . . . . 54.41 111.007 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.507 ' SD ' HD11 ' A' ' 98' ' ' LEU . 22.8 mmt -56.18 -41.99 76.39 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.046 -0.525 . . . . 74.55 111.206 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.67 -37.3 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.16 -0.473 . . . . 74.33 110.957 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -65.11 -28.83 69.71 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 122.339 -0.225 . . . . 70.43 111.388 177.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.99 -39.62 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 71.32 110.994 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.525 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 26.9 m-85 -89.0 26.92 1.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.302 -0.408 . . . . 73.11 112.034 178.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.8 t -73.86 -12.19 60.6 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.944 0.402 . . . . 75.31 111.104 175.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.06 137.94 31.95 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.242 -0.435 . . . . 72.14 110.507 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -119.64 37.34 3.16 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 120.525 -0.845 . . . . 73.14 114.808 -172.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.0 m -121.09 169.98 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 117.86 0.83 . . . . 54.15 111.067 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.9 p -76.09 91.71 3.14 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.325 0.491 . . . . 74.34 112.325 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -147.57 103.64 3.55 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.494 0.664 . . . . 73.32 111.682 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -63.17 -11.2 18.92 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.239 -0.437 . . . . 65.35 112.109 -178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.94 -26.83 55.88 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 121.416 -0.421 . . . . 53.11 112.998 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -62.67 -42.17 99.48 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.054 0.454 . . . . 53.03 110.369 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -63.27 -45.26 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.896 -0.593 . . . . 72.44 110.561 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.44 -48.41 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.982 -0.553 . . . . 72.34 110.948 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.4 m -57.26 -45.66 83.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.563 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.525 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 23.8 tp -57.77 -54.94 41.2 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.343 0.592 . . . . 73.04 111.797 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.425 HG23 ' CD2' ' A' ' 16' ' ' TYR . 51.7 mt -71.62 -37.53 63.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.864 -0.607 . . . . 71.41 112.08 -174.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 92.3 p -66.94 -44.08 81.53 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.631 0.253 . . . . 42.35 111.263 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.48 -40.19 93.64 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.799 0.333 . . . . 70.32 110.717 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.14 -47.61 86.22 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.895 -0.669 . . . . 75.05 112.365 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.01 79.6 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.098 0.475 . . . . 65.23 111.5 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 80.2 t80 -62.01 -45.73 92.29 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.059 -0.519 . . . . 74.52 111.325 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 56.2 t -69.93 -38.39 75.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 120.836 0.351 . . . . 75.54 110.787 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.76 69.13 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.292 0.479 . . . . 74.03 112.292 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 18.1 ptpt -62.83 -36.55 83.57 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.851 0.357 . . . . 73.34 111.227 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.419 ' O ' HG12 ' A' ' 112' ' ' ILE . 71.7 t60 -65.3 -33.7 76.59 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.909 0.385 . . . . 65.22 110.33 176.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.493 HD23 ' HB ' ' A' ' 68' ' ' ILE . 89.0 mt -67.41 -50.56 58.96 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.093 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -57.04 -40.57 77.02 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.166 0.508 . . . . 63.43 110.477 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.8 m -55.97 -48.91 74.95 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.604 -0.725 . . . . 64.51 111.699 175.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 108' ' ' HIS . 37.1 pt -88.7 22.2 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 N-CA-C 112.142 0.423 . . . . 62.21 112.142 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 68.32 12.11 8.61 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.918 0.71 . . . . 74.4 112.918 174.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -94.76 38.08 1.12 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.289 0.477 . . . . 71.31 112.289 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.87 -32.27 63.53 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.924 -0.485 . . . . 75.03 110.87 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.7 m -56.9 -29.1 62.71 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.216 -0.447 . . . . 74.33 111.873 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.441 ' HB2' HD12 ' A' ' 109' ' ' LEU . 44.5 m -76.99 -27.07 54.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.485 -0.325 . . . . 71.11 111.706 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.9 mt -59.54 -38.47 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.95 0.352 . . . . 73.02 111.95 -179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.7 -57.17 28.4 Favored Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 112.058 0.392 . . . . 72.13 112.058 -176.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.74 -26.9 60.22 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 121.669 1.579 . . . . 73.02 112.367 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.81 -48.42 76.92 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.706 0.288 . . . . 75.22 110.235 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.39 -40.69 71.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.223 0.535 . . . . 70.42 111.001 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.69 -35.84 79.57 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.928 -0.578 . . . . 64.41 111.357 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.6 m -63.68 -45.41 90.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.731 0.301 . . . . 62.0 111.314 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.469 HG23 HD12 ' A' ' 13' ' ' ILE . 48.5 mm -54.84 -50.64 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.352 0.596 . . . . 73.12 110.636 175.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 26.7 m -67.93 -33.63 75.06 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.545 -0.752 . . . . 72.45 111.52 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' A' ' 131' ' ' ARG . 15.2 t70 -64.02 -52.73 58.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.375 -0.375 . . . . 51.3 110.681 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 98.5 t -62.49 -41.73 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.149 0.5 . . . . 70.23 110.821 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.532 ' HG ' HD13 ' A' ' 137' ' ' LEU . 48.9 tp -54.32 -52.8 60.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.848 -0.614 . . . . 75.23 111.235 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.46 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 83.2 t -76.02 -27.33 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.157 -0.474 . . . . 73.32 111.9 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 127' ' ' ASP . 0.7 OUTLIER -54.85 -38.12 67.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.22 0.452 . . . . 75.05 112.22 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -130.46 -37.41 1.4 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.154 0.798 . . . . 64.34 113.154 -175.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.405 ' HA ' ' HD1' ' A' ' 136' ' ' TRP . 0.2 OUTLIER -92.5 6.16 48.15 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.971 0.73 . . . . 40.53 112.971 -177.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 12.7 ttp180 -49.83 -64.44 0.81 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.719 0.637 . . . . 74.31 112.719 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.09 -34.06 69.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 75.42 111.924 -178.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . 0.405 ' HD1' ' HA ' ' A' ' 133' ' ' LYS . 50.3 m95 -65.79 -36.52 83.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.303 -0.248 . . . . 74.11 111.222 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.549 ' HB2' HD23 ' A' ' 5' ' ' LEU . 78.5 mt -57.7 -49.01 77.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.811 0.338 . . . . 72.22 111.555 175.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.71 -38.02 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 N-CA-C 112.3 0.482 . . . . 73.51 112.3 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -69.66 -50.31 45.28 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.09 0.404 . . . . 73.45 112.09 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -85.41 1.8 47.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.69 0.281 . . . . 72.14 111.342 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 141' ' ' ARG . 23.2 mtp85 51.59 52.75 14.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.078 -0.51 . . . . 75.31 110.919 -175.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -41.89 -58.04 3.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 114.994 0.758 . . . . 50.22 114.994 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -64.25 -20.25 65.92 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 117.512 0.656 . . . . 75.24 112.629 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -86.52 -57.8 2.86 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.942 0.401 . . . . 74.2 111.511 172.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.3 -34.73 89.26 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.363 -0.38 . . . . 63.24 114.007 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -58.12 -37.62 74.93 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.091 0.472 . . . . 65.54 111.708 177.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.615 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.7 t -72.36 -47.81 50.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.928 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -68.51 -28.09 66.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.02 0.438 . . . . 73.4 111.166 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -55.38 -50.84 68.67 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.022 -0.536 . . . . 64.41 110.866 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.58 -25.97 24.7 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.124 -0.489 . . . . 70.2 111.922 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.401 ' HB3' ' NE2' ' A' ' 159' ' ' HIS . 77.8 t60 71.31 106.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.83 0.852 . . . . 61.21 112.242 -175.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.501 HG12 ' HG2' ' A' ' 153' ' ' GLU . 51.7 t -142.05 -73.89 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.977 -0.556 . . . . 73.44 110.925 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.635 ' HB2' ' HB2' ' A' ' 39' ' ' LYS . 22.0 mm-40 -113.32 23.64 13.04 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.098 0.475 . . . . 75.4 111.534 -177.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.85 134.48 33.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.284 -0.417 . . . . 62.42 111.418 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -11.08 59.85 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 71.4 111.347 176.089 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -68.21 -40.05 82.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.878 0.37 . . . . 71.25 111.225 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 66.08 58.26 9.23 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.252 -0.431 . . . . 73.02 113.729 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -163.2 -172.75 31.07 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 120.813 -0.708 . . . . 37.79 113.473 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . 0.401 ' NE2' ' HB3' ' A' ' 151' ' ' HIS . 66.2 m80 -137.96 93.59 2.79 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.868 0.366 . . . . 71.14 111.165 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -91.99 76.32 5.48 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.335 0.588 . . . . 75.33 110.479 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -84.68 95.78 9.01 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.307 -0.406 . . . . 75.31 111.163 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -90.69 123.8 34.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.789 0.328 . . . . 73.25 111.052 177.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -142.02 141.58 32.84 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.645 0.26 . . . . 74.13 110.968 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.735 -0.65 . . . . 62.55 111.431 177.903 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 120.84 0.353 . . . . 60.15 110.894 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -172.33 178.8 2.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.151 -0.477 . . . . 73.02 111.065 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -83.58 148.31 27.24 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.15 0.5 . . . . 74.3 111.553 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -58.97 -43.28 91.34 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.139 0.495 . . . . 74.5 111.481 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 137' ' ' LEU . 65.9 tp -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.98 -0.555 . . . . 74.21 111.084 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -62.01 -43.34 99.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.168 -0.469 . . . . 75.45 110.952 176.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -69.08 -39.43 79.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.472 0.545 . . . . 64.03 112.472 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -60.84 -49.54 77.08 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.12 0.486 . . . . 71.32 110.742 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.8 m -61.89 -47.31 85.56 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.079 -0.51 . . . . 75.32 111.117 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.47 -37.8 79.14 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.395 -0.366 . . . . 63.32 111.225 177.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.72 -53.68 55.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.332 0.587 . . . . 61.13 110.763 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -63.77 -49.77 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.662 -0.699 . . . . 75.23 111.754 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.441 ' O ' HD11 ' A' ' 17' ' ' LEU . 75.3 mt -63.72 -52.12 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 112.146 0.425 . . . . 71.24 112.146 -177.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.6 t -57.17 -48.37 78.89 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-O 120.964 0.411 . . . . 72.14 111.843 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.408 ' NH2' ' O ' ' A' ' 28' ' ' LYS . 57.3 mtp180 -63.4 -40.3 96.84 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.308 -0.405 . . . . 74.14 111.629 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -60.29 -53.33 58.9 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.869 0.366 . . . . 74.32 111.089 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD11 ' O ' ' A' ' 13' ' ' ILE . 9.7 mp -54.92 -39.95 69.34 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.743 0.306 . . . . 65.04 111.293 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -57.22 10.78 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.546 -0.297 . . . . 65.42 111.662 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -61.48 -32.38 72.38 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.0 0.428 . . . . 72.22 111.285 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.46 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 25.4 mm-40 -65.85 -33.98 77.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.176 -0.466 . . . . 72.02 111.852 175.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.98 -41.1 71.45 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.912 0.386 . . . . 71.33 111.433 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.9 p -86.96 -20.75 26.85 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.004 0.43 . . . . 54.35 111.84 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.27 26.13 66.8 Favored Glycine 0 CA--C 1.524 0.65 0 C-N-CA 121.294 -0.479 . . . . 75.01 112.591 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.75 131.8 26.24 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.266 0.227 . . . . 63.42 111.223 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -47.82 146.18 2.5 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.589 0.959 . . . . 74.15 113.589 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.67 170.29 12.61 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.834 -0.621 . . . . 73.34 110.97 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -151.03 22.46 0.76 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.811 0.671 . . . . 74.1 112.811 -177.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -92.08 161.82 32.18 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 122.471 0.308 . . . . 75.54 111.573 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -68.26 148.96 75.4 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 122.559 2.172 . . . . 65.43 112.053 172.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.451 ' SD ' ' HB3' ' A' ' 37' ' ' SER . 9.2 mmt -90.99 78.5 5.96 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.679 0.992 . . . . 71.22 113.679 -175.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 32.41 -116.6 0.11 Allowed Glycine 0 CA--C 1.533 1.172 0 CA-C-N 114.97 -1.014 . . . . 71.21 115.354 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 31.6 ttm180 -117.49 5.09 12.45 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.282 0.563 . . . . 64.41 111.361 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.7 m -113.41 -12.44 12.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.501 0.556 . . . . 75.52 112.501 -173.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 52.63 -111.98 1.89 Allowed Glycine 0 CA--C 1.534 1.235 0 N-CA-C 114.633 0.613 . . . . 72.14 114.633 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.79 73.35 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.931 0.715 . . . . 43.22 112.931 -173.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.0 m -54.29 -51.23 65.27 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.129 0.49 . . . . 73.2 111.581 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.451 ' HB3' ' SD ' ' A' ' 30' ' ' MET . 66.8 m -63.6 -35.5 80.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.076 -0.511 . . . . 73.31 111.981 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 61.3 ttt180 -66.04 -55.79 14.84 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.83 0.348 . . . . 75.43 111.066 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.483 ' HE2' HG12 ' A' ' 147' ' ' VAL . 59.0 mtpt -55.95 -42.29 75.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.085 -0.507 . . . . 71.13 111.352 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.63 -45.57 91.6 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.319 -0.401 . . . . 61.34 111.287 174.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.07 -54.85 35.6 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.892 0.377 . . . . 63.34 111.977 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -66.87 -30.79 71.04 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.919 0.34 . . . . 73.23 111.919 -178.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.541 ' O ' HG23 ' A' ' 47' ' ' VAL . 95.6 m -69.72 -40.91 75.97 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.093 -0.38 . . . . 64.13 110.748 174.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.2 mt -53.99 -37.29 63.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.217 0.532 . . . . 74.4 110.595 171.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -68.18 -52.75 30.95 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.146 -0.479 . . . . 72.1 111.712 175.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.53 ' NE ' ' HA ' ' A' ' 43' ' ' THR . 3.2 ptp180 -66.24 -21.65 66.3 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.634 0.605 . . . . 61.03 112.634 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 43' ' ' THR . 23.3 m -110.09 -33.79 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 122.057 -0.402 . . . . 72.21 111.885 176.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.43 -32.57 71.77 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 121.5 -0.381 . . . . 61.45 113.947 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.522 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 28.3 t70 -61.9 -52.15 65.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 117.401 0.601 . . . . 74.02 110.757 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.41 -41.53 95.27 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.47 -0.395 . . . . 65.33 112.977 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 47' ' ' VAL . 69.8 t -59.89 -49.65 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 120.8 0.333 . . . . 74.23 111.084 175.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.517 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 44.5 mt-30 -57.16 -35.98 70.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.585 -0.28 . . . . 52.03 111.508 177.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.4 mmm180 -58.01 -59.76 4.78 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.795 0.331 . . . . 75.33 111.872 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -74.93 -19.29 60.19 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.095 0.406 . . . . 73.33 112.095 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.457 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 37.8 m-70 -90.99 -22.81 20.62 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.529 0.566 . . . . 71.53 112.529 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.486 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 30.0 tt0 -54.56 -51.75 64.24 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.787 0.327 . . . . 64.52 111.818 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -53.37 -29.88 36.76 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.096 0.474 . . . . 73.44 111.771 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.48 -53.86 5.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.073 0.463 . . . . 73.1 111.556 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.457 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 15.1 m-85 -58.94 -30.01 67.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.498 0.555 . . . . 74.34 112.498 -177.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -51.16 -40.98 59.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 120.956 0.408 . . . . 75.25 111.404 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.455 ' HA2' ' CZ ' ' A' ' 64' ' ' ARG . . . -61.96 -28.41 70.31 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 121.203 -0.523 . . . . 75.14 113.158 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 81.1 mtp -89.51 -33.23 16.84 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.378 0.608 . . . . 71.33 110.335 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.423 HD21 ' CE2' ' A' ' 104' ' ' PHE . 13.0 tp -63.46 -41.37 98.61 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.744 -0.662 . . . . 62.54 111.449 -176.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.455 ' CZ ' ' HA2' ' A' ' 61' ' ' GLY . 13.3 ptt180 -67.84 -26.0 65.83 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.267 -0.424 . . . . 74.53 111.196 176.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.14 -32.66 56.5 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.069 0.462 . . . . 73.42 111.256 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.75 -73.13 0.41 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.075 -0.511 . . . . 72.3 111.531 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.1 t70 45.35 83.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.438 0.637 . . . . 64.5 111.735 -175.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.467 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.0 mp -64.95 114.62 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 115.9 -0.591 . . . . 64.15 112.17 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -103.89 -8.06 19.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 111.872 0.323 . . . . 61.13 111.872 175.389 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.465 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.6 170.39 14.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.795 0.331 . . . . 60.52 111.738 175.12 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.401 ' O ' ' HB ' ' A' ' 74' ' ' VAL . 42.5 tt0 -57.22 -28.55 62.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.315 0.487 . . . . 72.21 112.315 -177.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.98 -39.8 75.32 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 122.183 -0.323 . . . . 70.25 111.768 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -60.97 -43.09 99.26 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.499 0.666 . . . . 74.42 109.742 175.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.479 HG11 ' HA ' ' A' ' 121' ' ' LEU . 69.4 t -58.87 -38.29 72.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.301 -0.863 . . . . 74.34 111.561 175.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -64.7 -40.77 95.94 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.992 0.425 . . . . 71.15 110.729 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 t -64.61 -33.82 76.81 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.136 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.49 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.7 mt -55.82 -33.34 64.37 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.499 -0.319 . . . . 73.51 111.712 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.3 t -54.7 -39.47 68.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.864 0.364 . . . . 73.24 111.123 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.417 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 23.9 mmt180 -58.86 -47.58 84.39 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.281 -0.418 . . . . 65.23 111.375 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.34 -40.71 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.066 0.46 . . . . 75.23 111.112 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.49 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -57.82 -40.27 79.59 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.973 -0.558 . . . . 75.35 111.565 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 75.9 mt -57.78 -37.1 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 121.081 0.467 . . . . 55.42 111.085 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.417 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 71.4 m-70 -72.29 -27.51 62.51 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.414 -0.357 . . . . 74.34 111.631 177.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 84.9 t -57.45 -38.36 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 120.907 0.384 . . . . 60.22 111.26 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.439 ' CE2' HD23 ' A' ' 98' ' ' LEU . 39.6 m-85 -83.53 10.51 8.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.547 0.573 . . . . 74.42 112.547 178.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.4 t -65.96 -26.65 67.66 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.095 0.474 . . . . 62.3 110.838 176.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -81.55 111.33 17.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.109 -0.496 . . . . 63.32 110.626 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.72 47.69 1.3 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 121.263 -0.494 . . . . 42.23 114.274 -172.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.5 t -79.81 -17.08 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 122.285 -0.538 . . . . 54.3 111.165 176.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 51.1 p 54.22 24.95 5.32 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.101 0.778 . . . . 64.14 113.101 175.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.424 ' C ' ' H ' ' A' ' 93' ' ' GLY . 31.7 p30 -84.88 11.18 9.81 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.703 0.631 . . . . 65.53 112.703 -177.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.3 m95 68.19 -25.89 0.13 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 112.92 0.711 . . . . 73.14 112.92 -176.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 91' ' ' ASN . . . -57.57 -25.63 55.65 Favored Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.998 -0.439 . . . . 61.32 113.072 176.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.745 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.1 mmp_? -62.73 -34.59 77.49 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.535 -0.391 . . . . 60.13 111.275 174.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.3 mm -61.93 -45.94 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.207 0.527 . . . . 51.15 109.876 174.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.0 t -57.71 -42.96 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.746 -0.661 . . . . 45.13 110.967 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.4 m -57.7 -48.2 80.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.382 -0.372 . . . . 74.22 111.137 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 125' ' ' ILE . 37.3 tp -60.02 -54.39 46.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.152 0.501 . . . . 71.32 111.847 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.6 mt -69.62 -34.19 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 CA-C-N 116.284 -0.416 . . . . 63.5 111.921 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.517 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 97.3 p -63.83 -47.37 81.04 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.397 -0.189 . . . . 75.35 111.437 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.42 ' O ' HG21 ' A' ' 105' ' ' VAL . 24.5 t80 -59.7 -41.14 90.1 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.797 0.332 . . . . 74.42 110.833 176.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.64 -45.12 95.14 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.872 -0.68 . . . . 73.23 112.452 175.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.46 ' HB1' ' HG3' ' A' ' 20' ' ' GLN . . . -65.41 -34.6 78.67 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.178 0.514 . . . . 74.04 111.465 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.486 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 58.5 t80 -63.13 -48.35 78.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.895 -0.593 . . . . 74.44 111.321 175.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.42 HG21 ' O ' ' A' ' 101' ' ' PHE . 52.7 t -66.76 -37.36 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.622 -0.263 . . . . 75.54 110.824 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.38 -44.01 68.29 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.992 0.425 . . . . 64.42 111.428 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -55.12 -47.4 75.08 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.157 0.503 . . . . 62.11 110.956 173.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.449 ' O ' HG12 ' A' ' 112' ' ' ILE . 64.8 t60 -65.45 -34.02 77.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.181 -0.463 . . . . 74.11 111.586 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 86.7 mt -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.52 0.2 . . . . 74.21 111.084 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -59.27 -41.75 89.59 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.033 0.444 . . . . 62.41 110.479 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 61.1 m -54.05 -45.52 71.69 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.92 -0.582 . . . . 73.23 111.83 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -93.63 17.46 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 112.097 0.406 . . . . 73.11 112.097 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 71.48 6.62 5.79 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.367 0.877 . . . . 72.34 113.367 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -81.7 45.42 0.89 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.886 0.374 . . . . 74.22 111.389 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -55.54 -43.02 75.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.994 0.518 . . . . 74.42 111.573 -176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.7 p -62.38 -34.56 76.94 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.418 -0.355 . . . . 72.32 111.938 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.2 m -59.43 -26.0 64.81 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.446 0.536 . . . . 75.54 112.446 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.2 mt -53.87 -39.57 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 112.437 0.532 . . . . 74.15 112.437 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.1 -56.77 10.37 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.752 0.649 . . . . 73.12 112.752 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.3 -28.52 72.33 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 121.714 1.609 . . . . 73.54 112.289 176.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.479 ' HA ' HG11 ' A' ' 74' ' ' VAL . 6.4 tt -66.3 -46.58 76.47 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.958 0.409 . . . . 75.25 110.071 174.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.252 -0.431 . . . . 62.41 111.326 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.17 -47.06 81.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.301 -0.409 . . . . 74.53 111.079 175.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.5 m -55.81 -44.36 77.79 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 120.873 0.368 . . . . 74.52 111.23 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.506 HG22 ' HG ' ' A' ' 98' ' ' LEU . 48.9 mm -59.57 -53.5 47.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.172 0.511 . . . . 53.41 111.136 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.8 m -63.0 -36.09 82.41 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.892 -0.594 . . . . 75.55 111.584 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 28.5 t70 -61.08 -52.32 65.4 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.517 -0.31 . . . . 75.34 111.389 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.488 HG21 ' HB2' ' A' ' 81' ' ' MET . 61.5 t -64.43 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.187 0.518 . . . . 73.51 110.972 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.533 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.5 tp -55.99 -52.85 62.71 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.765 -0.652 . . . . 74.41 111.067 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.496 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 58.7 t -76.09 -24.26 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 115.944 -0.571 . . . . 75.35 111.512 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.9 tpt180 -57.36 -45.55 84.26 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.246 0.461 . . . . 73.44 112.246 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.422 ' C ' ' HD2' ' A' ' 133' ' ' LYS . 2.4 t -114.86 -30.75 6.33 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.906 1.076 . . . . 65.43 113.906 -172.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.422 ' HD2' ' C ' ' A' ' 132' ' ' THR . 13.2 mptt -116.88 29.78 7.72 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.086 0.773 . . . . 72.2 113.086 -176.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.496 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 58.2 ttp180 -60.92 -54.6 43.09 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 120.919 0.39 . . . . 75.43 111.877 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -59.68 -36.74 77.08 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.226 -0.443 . . . . 54.11 111.542 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -69.71 -36.82 76.24 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.752 0.279 . . . . 74.24 111.752 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.533 HD11 ' HG ' ' A' ' 129' ' ' LEU . 38.2 mt -57.47 -44.97 85.3 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 111.721 0.267 . . . . 70.12 111.721 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.0 p -78.25 -43.23 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 112.364 0.505 . . . . 63.34 112.364 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -68.59 -36.74 79.12 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.834 0.679 . . . . 74.12 112.834 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -101.13 3.23 40.99 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.178 -0.327 . . . . 74.51 111.531 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 49.65 63.97 1.95 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.043 0.449 . . . . 74.55 110.574 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.09 -47.01 6.46 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 115.114 0.806 . . . . 75.2 115.114 -171.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -75.09 -20.59 59.41 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.676 0.621 . . . . 71.14 112.676 -175.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -84.44 -51.44 6.93 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.054 0.454 . . . . 75.43 110.466 170.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.562 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.91 -32.45 66.35 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.902 -0.59 . . . . 71.43 113.012 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -58.22 -39.91 80.31 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.148 0.499 . . . . 73.33 110.983 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.483 HG12 ' HE2' ' A' ' 39' ' ' LYS . 60.4 t -73.16 -40.46 57.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 116.12 -0.491 . . . . 60.01 111.774 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.562 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 13.7 pt-20 -73.39 -33.85 65.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 111.897 0.332 . . . . 72.24 111.897 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.53 -45.72 92.81 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 75.33 111.603 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -82.3 -9.94 59.29 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.821 0.343 . . . . 73.34 111.311 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 54.78 86.71 0.05 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.687 0.756 . . . . 73.45 111.774 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 74.8 t -94.43 -61.3 2.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.24 -0.891 . . . . 74.22 111.819 -174.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -108.39 10.92 27.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.303 0.573 . . . . 72.51 111.21 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.27 124.57 19.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.84 0.681 . . . . 63.14 112.84 -178.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -21.81 65.94 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.179 -0.464 . . . . 63.32 111.42 173.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -75.31 -64.85 0.97 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.377 0.608 . . . . 74.0 111.474 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 108.87 -147.81 16.79 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-N 115.655 -0.702 . . . . 43.42 111.796 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 87.63 124.24 1.96 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.875 -0.678 . . . . 73.43 113.483 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -142.0 146.9 36.1 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 122.428 -0.454 . . . . 70.12 110.74 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -73.46 86.05 1.53 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 120.983 0.421 . . . . 71.4 111.64 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -118.14 22.88 11.95 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.369 0.604 . . . . 73.42 110.724 176.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -163.45 102.65 0.94 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.525 -0.761 . . . . 75.52 110.059 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -120.17 127.7 52.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.069 0.462 . . . . 65.25 112.052 -175.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.84 -0.6 . . . . 73.43 111.083 174.78 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.481 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.475 0 CA-C-O 120.592 0.234 . . . . 75.24 110.75 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -66.35 146.99 53.96 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.298 0.571 . . . . 75.32 112.211 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -91.07 146.0 24.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.943 -0.571 . . . . 75.01 110.294 170.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 -38.35 53.04 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.465 0.65 . . . . 65.55 111.055 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 137' ' ' LEU . 63.3 tp -68.82 -35.79 77.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.404 -0.816 . . . . 74.32 112.13 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -69.8 -43.85 71.24 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.981 0.419 . . . . 73.24 110.175 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -59.62 -51.69 68.75 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.048 -0.524 . . . . 61.0 111.418 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -61.57 -52.2 65.41 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.73 0.3 . . . . 61.21 111.75 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.4 m -56.33 -45.48 80.32 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.684 0.278 . . . . 75.22 111.098 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.66 -41.51 95.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.701 0.286 . . . . 75.52 111.279 176.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -60.58 -48.49 81.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.039 0.447 . . . . 71.52 110.748 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.547 HG12 ' HE2' ' A' ' 30' ' ' MET . 69.5 mt -60.77 -54.12 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 121.109 0.48 . . . . 74.34 111.616 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.453 ' O ' HD11 ' A' ' 17' ' ' LEU . 88.8 mt -61.21 -52.02 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.034 -0.53 . . . . 71.24 111.68 -178.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.8 t -53.58 -47.53 70.03 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.824 0.345 . . . . 71.43 111.197 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 11.1 mtp180 -56.2 -55.62 30.9 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.379 -0.373 . . . . 51.41 111.568 176.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -54.83 -43.78 73.32 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.674 0.274 . . . . 75.54 111.473 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.516 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.8 mp -59.95 -43.54 94.96 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.756 0.313 . . . . 73.31 111.204 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.65 -50.41 67.2 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.798 0.333 . . . . 72.11 111.619 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 25.9 mt-10 -60.44 -38.63 84.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.056 0.455 . . . . 62.21 111.388 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.579 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 29.0 mm-40 -69.83 -46.1 66.38 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.312 -0.403 . . . . 73.32 111.889 176.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.7 81.22 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.1 0.407 . . . . 71.55 112.1 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.7 p -87.45 -28.22 22.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.707 0.289 . . . . 73.41 111.77 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.26 35.14 27.53 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.082 -0.58 . . . . 53.32 112.682 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -152.46 -173.19 4.47 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.403 0.281 . . . . 65.42 110.933 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -97.78 142.94 28.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.114 0.483 . . . . 74.45 111.542 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -100.64 167.57 10.25 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.926 -0.579 . . . . 62.11 110.666 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.9 t -141.87 33.08 1.58 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.378 0.609 . . . . 75.11 112.056 -177.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -73.65 139.04 77.27 Favored Pre-proline 0 N--CA 1.473 0.708 0 O-C-N 122.105 -0.372 . . . . 64.41 111.257 175.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -53.89 122.63 11.71 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.851 2.367 . . . . 71.22 112.777 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.547 ' HE2' HG12 ' A' ' 12' ' ' ILE . 3.5 tpt -75.68 169.79 17.44 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 112.779 0.659 . . . . 74.42 112.779 -171.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.39 -174.21 18.98 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 114.958 0.743 . . . . 51.5 114.958 -174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.503 ' HD3' ' N ' ' A' ' 33' ' ' SER . 0.1 OUTLIER -53.12 -43.91 67.26 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.275 0.843 . . . . 64.34 113.275 -175.093 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.503 ' N ' ' HD3' ' A' ' 32' ' ' ARG . 74.6 m -86.37 93.29 9.07 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.927 -0.483 . . . . 64.04 110.554 174.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.67 -68.19 1.81 Allowed Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.363 -0.381 . . . . 72.2 113.718 -175.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -49.21 71.15 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 111.842 0.312 . . . . 71.23 111.842 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.483 ' HB ' ' HB3' ' A' ' 33' ' ' SER . 77.7 m -54.63 -46.81 73.98 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.745 0.307 . . . . 72.34 111.806 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.7 m -65.02 -35.63 81.8 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.633 0.254 . . . . 63.42 111.579 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.446 ' NH1' ' HB3' ' A' ' 42' ' ' GLU . 18.1 tpt85 -64.81 -50.47 66.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.818 0.342 . . . . 61.15 110.663 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' A' ' 153' ' ' GLU . 54.4 mtpt -59.69 -43.63 93.98 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.809 -0.632 . . . . 72.42 111.35 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.14 81.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.97 0.414 . . . . 75.13 111.215 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.415 ' HG ' HH21 ' A' ' 45' ' ' ARG . 49.0 tp -61.49 -36.76 81.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.277 -0.419 . . . . 63.02 111.852 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.446 ' HB3' ' NH1' ' A' ' 38' ' ' ARG . 15.8 pt-20 -78.99 -37.8 38.35 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.134 -0.354 . . . . 75.45 111.137 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.496 HG21 HG23 ' A' ' 152' ' ' VAL . 95.4 m -63.12 -35.23 79.58 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.893 0.378 . . . . 74.3 110.808 175.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -56.81 -32.76 66.04 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.983 0.421 . . . . 63.5 111.161 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.44 HH22 ' CD ' ' A' ' 19' ' ' GLU . 32.2 mtt-85 -79.07 -43.72 23.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.078 0.466 . . . . 75.23 110.415 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -44.8 59.84 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.588 -0.733 . . . . 75.51 112.324 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.424 ' O ' HG23 ' A' ' 51' ' ' VAL . 34.0 m -106.81 -34.49 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 112.267 0.469 . . . . 71.02 112.267 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.78 -39.64 97.73 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.28 -0.486 . . . . 61.51 113.473 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.35 -56.33 23.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.936 0.398 . . . . 74.32 110.974 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.38 -48.17 77.59 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-N 116.034 -0.53 . . . . 73.42 112.797 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.4 t -57.45 -50.86 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 O-C-N 122.851 -0.205 . . . . 75.13 111.216 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -53.84 -46.91 71.34 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.689 0.255 . . . . 72.51 111.689 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -60.86 -45.69 93.55 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.857 0.688 . . . . 71.02 112.857 -176.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -84.76 -21.2 30.08 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.692 -0.63 . . . . 54.11 112.052 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -90.4 -18.29 25.71 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.322 0.489 . . . . 74.53 112.322 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 40.6 tt0 -49.07 -46.04 43.91 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.558 0.577 . . . . 74.34 112.558 -174.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.2 t -56.17 -35.28 67.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.907 0.384 . . . . 64.4 111.965 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.57 -44.01 21.9 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.811 0.338 . . . . 72.24 111.737 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -59.9 -47.33 86.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.605 -0.27 . . . . 74.52 111.35 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.475 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 75.4 mm-40 -53.15 -38.19 62.49 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.87 0.367 . . . . 61.22 111.028 176.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.24 -41.21 86.31 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.03 -0.605 . . . . 64.44 112.313 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 39.9 mtm -72.78 -34.13 66.73 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.483 -0.422 . . . . 72.51 111.148 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.0 -33.62 73.54 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.647 0.261 . . . . 75.14 110.916 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.475 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 47.3 mtm180 -68.83 -17.3 63.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.156 0.503 . . . . 70.21 111.239 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -95.6 -20.35 19.04 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 72.24 110.917 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.6 mt -99.83 -82.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.06 -0.518 . . . . 51.11 111.865 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.7 t0 48.63 98.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.702 0.763 . . . . 63.21 111.97 -172.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.439 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.6 mp -76.32 123.81 33.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 115.614 -0.721 . . . . 74.0 111.904 -175.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.402 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -113.25 -5.55 13.63 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.22 0.452 . . . . 52.43 112.22 177.148 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.402 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -167.35 174.14 8.28 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.924 0.392 . . . . 71.43 111.625 173.379 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.08 -38.91 58.79 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.434 0.531 . . . . 75.52 112.434 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -51.3 -41.79 60.74 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.241 0.459 . . . . 75.24 112.241 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.439 ' HB2' HG21 ' A' ' 68' ' ' ILE . 20.5 m-20 -63.21 -43.11 99.04 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.889 0.376 . . . . 70.4 110.647 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.51 HG23 ' HB3' ' A' ' 117' ' ' SER . 72.6 t -56.38 -43.43 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.92 -0.582 . . . . 73.35 110.993 177.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -73.07 -29.38 62.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.186 -0.461 . . . . 64.44 111.511 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.8 m -68.39 -28.67 67.31 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.933 0.397 . . . . 71.33 110.851 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 86.7 mt -55.67 -28.38 55.18 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.339 -0.391 . . . . 74.21 111.452 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.416 ' O ' HG13 ' A' ' 82' ' ' ILE . 81.3 p -52.13 -35.27 47.85 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 120.798 0.333 . . . . 74.12 111.373 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -61.75 -45.55 93.42 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.99 0.424 . . . . 74.22 110.713 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 82.4 t -64.16 -42.79 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.141 0.496 . . . . 74.03 110.354 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.472 ' SD ' HD11 ' A' ' 98' ' ' LEU . 21.7 mmt -56.17 -38.93 71.59 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.709 -0.678 . . . . 71.13 111.673 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 78' ' ' SER . 85.0 mt -64.37 -41.24 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.098 0.475 . . . . 74.14 110.911 174.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -64.73 -27.93 69.24 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.046 0.388 . . . . 65.42 112.046 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.0 t -55.28 -34.63 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 121.016 0.436 . . . . 62.14 111.911 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -79.82 42.45 0.54 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 112.057 0.392 . . . . 74.52 112.057 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.3 t -129.64 36.05 4.13 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.133 0.492 . . . . 75.21 111.521 -175.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.509 ' OD1' ' HB3' ' A' ' 94' ' ' ARG . 1.5 m-20 -57.91 -28.82 64.58 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.793 0.664 . . . . 64.22 112.793 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 90.79 -10.08 75.85 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.058 -0.591 . . . . 64.55 111.994 -171.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.423 HG11 ' HE2' ' A' ' 164' ' ' HIS . 25.8 m -139.61 136.97 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 123.387 0.675 . . . . 64.42 110.261 176.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 t -75.15 96.26 3.24 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.637 0.732 . . . . 71.23 111.552 -177.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -132.15 -172.55 2.91 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.862 -0.608 . . . . 64.1 111.443 -176.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.42 ' HE3' HG13 ' A' ' 95' ' ' ILE . 79.4 m95 -102.09 3.62 38.82 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.964 0.411 . . . . 73.52 110.701 171.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.64 -41.36 99.83 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.311 -0.404 . . . . 71.34 112.589 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.509 ' HB3' ' OD1' ' A' ' 87' ' ' ASP . 19.6 ptt180 -51.77 -38.14 54.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.901 0.381 . . . . 75.02 111.636 171.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.42 HG13 ' HE3' ' A' ' 92' ' ' TRP . 36.9 mm -69.6 -43.21 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.987 0.423 . . . . 65.12 110.561 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.69 -53.19 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.199 -0.455 . . . . 74.14 111.029 175.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.9 m -57.79 -45.0 86.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.226 -0.443 . . . . 72.12 111.504 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.494 ' HG ' HG22 ' A' ' 125' ' ' ILE . 26.7 tp -57.33 -54.63 44.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.167 0.508 . . . . 54.24 111.631 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.84 -41.94 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.236 -0.438 . . . . 74.54 111.739 -178.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.9 m -63.02 -41.18 99.48 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.674 0.273 . . . . 53.23 111.391 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 105' ' ' VAL . 29.5 t80 -68.89 -40.15 79.36 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.681 0.277 . . . . 74.14 110.742 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.17 -48.01 83.24 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 120.834 -0.698 . . . . 37.55 112.221 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.516 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.9 -35.13 80.14 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.136 0.494 . . . . 62.2 111.374 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.416 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 44.2 t80 -61.83 -50.89 70.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.905 -0.588 . . . . 73.15 110.919 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 101' ' ' PHE . 59.3 t -62.33 -38.54 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 116.33 -0.395 . . . . 73.41 110.815 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.33 -41.01 71.89 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.871 0.367 . . . . 60.34 111.618 176.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.579 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 95.8 mttt -58.06 -44.87 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.057 0.456 . . . . 71.05 111.046 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.406 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -67.64 -36.46 80.83 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.346 -0.388 . . . . 75.54 111.163 177.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.48 -50.36 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.611 0.243 . . . . 72.53 111.556 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -60.92 -40.83 94.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.047 0.451 . . . . 63.24 110.712 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.1 m -58.81 -39.13 80.26 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.154 -0.475 . . . . 75.14 112.239 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 108' ' ' HIS . 38.5 pt -94.55 17.2 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.654 0.613 . . . . 71.34 112.654 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 71.74 12.59 6.28 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.747 0.647 . . . . 63.04 112.747 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -97.95 31.65 2.62 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.324 . . . . 74.14 111.347 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.413 ' HG3' HD11 ' A' ' 118' ' ' ILE . 38.4 tt0 -56.74 -35.64 68.84 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.196 0.443 . . . . 61.31 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.7 m -56.56 -27.51 57.93 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.026 0.441 . . . . 73.42 111.576 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.51 ' HB3' HG23 ' A' ' 74' ' ' VAL . 53.4 m -71.26 -25.82 62.63 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.405 0.521 . . . . 62.12 112.405 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.413 HD11 ' HG3' ' A' ' 115' ' ' GLU . 72.6 mt -53.59 -46.74 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 113.08 0.77 . . . . 75.12 113.08 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.58 -54.08 32.83 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 112.497 0.555 . . . . 63.3 112.497 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.19 -26.44 69.64 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.575 1.516 . . . . 71.4 112.492 174.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.41 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.4 tt -67.36 -44.65 78.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.717 -0.475 . . . . 74.53 109.717 173.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.42 ' HB3' HD23 ' A' ' 17' ' ' LEU . . . -59.16 -37.79 78.18 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.074 0.464 . . . . 71.43 111.099 174.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.14 -38.64 91.27 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.116 -0.493 . . . . 73.41 110.682 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.0 m -63.05 -44.17 96.58 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 120.815 0.341 . . . . 63.35 111.136 175.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.494 HG22 ' HG ' ' A' ' 98' ' ' LEU . 47.5 mm -56.34 -53.04 44.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.179 0.514 . . . . 71.01 110.656 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -63.7 -35.77 81.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.737 -0.665 . . . . 74.22 111.55 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 27.0 t70 -62.88 -52.06 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.539 -0.3 . . . . 71.35 111.396 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 65.0 t -62.23 -46.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.163 0.506 . . . . 73.35 110.442 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.546 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.7 tp -49.94 -53.07 28.53 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.526 -0.761 . . . . 65.53 111.673 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.497 HG12 ' HD3' ' A' ' 134' ' ' ARG . 71.2 t -76.92 -32.94 20.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.912 -0.586 . . . . 74.41 112.166 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 16.0 tpt180 -55.26 -33.13 62.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.008 0.432 . . . . 60.44 111.738 -176.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -40.73 3.35 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.672 0.619 . . . . 65.42 112.672 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -101.9 18.94 19.32 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.48 0.918 . . . . 73.3 113.48 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.497 ' HD3' HG12 ' A' ' 130' ' ' VAL . 14.8 tpt180 -47.28 -56.37 6.91 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.591 0.589 . . . . 73.11 112.591 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.35 -42.8 58.78 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.824 0.345 . . . . 70.43 111.069 -177.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -56.43 -37.37 70.13 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.503 -0.317 . . . . 75.55 111.824 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.546 HD11 ' HG ' ' A' ' 129' ' ' LEU . 18.4 mt -55.05 -51.17 67.16 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.421 -0.354 . . . . 72.3 111.924 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.1 p -77.78 -43.06 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.631 -0.668 . . . . 74.01 112.071 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -58.72 -40.59 84.18 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.233 0.457 . . . . 73.15 112.233 -177.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -101.66 10.85 39.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.27 0.557 . . . . 72.21 110.7 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.596 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 23.0 mtm180 67.17 7.21 5.28 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.349 -0.841 . . . . 75.02 113.088 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 137' ' ' LEU . . . 32.21 -82.65 0.0 OUTLIER Glycine 0 N--CA 1.468 0.827 0 N-CA-C 115.711 1.045 . . . . 73.14 115.711 173.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.428 ' N ' ' O ' ' A' ' 141' ' ' ARG . 40.2 m95 -70.87 -46.48 62.56 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.341 0.256 . . . . 72.43 111.382 -176.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.596 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 23.7 m-20 -61.85 -39.94 93.59 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.056 0.455 . . . . 73.1 110.025 170.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.55 91.14 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 115.85 -0.614 . . . . 63.3 112.503 176.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -67.14 -44.19 80.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.074 0.55 . . . . 65.54 111.111 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 143' ' ' TRP . 94.8 t -62.96 -44.29 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 116.199 -0.455 . . . . 64.43 111.898 178.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.58 -32.07 63.94 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.675 0.274 . . . . 71.33 111.738 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -55.82 -50.42 70.58 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.954 0.407 . . . . 71.12 111.79 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.18 -14.02 45.27 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.225 -0.443 . . . . 72.45 112.098 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.577 ' HB2' ' HB3' ' A' ' 159' ' ' HIS . 26.9 t-80 57.61 79.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.198 0.599 . . . . 72.03 111.569 -173.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.496 HG23 HG21 ' A' ' 43' ' ' THR . 93.1 t -107.09 -68.52 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.858 -0.61 . . . . 70.12 110.334 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.475 ' HB3' ' HE3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -105.77 67.27 0.75 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.543 0.687 . . . . 72.52 110.44 179.7 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.446 ' HB3' ' HD2' ' A' ' 151' ' ' HIS . 12.7 t70 -143.68 151.51 40.16 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.646 -0.706 . . . . 74.32 111.116 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -99.68 -23.54 15.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.239 0.829 . . . . 74.04 113.239 -174.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -81.59 -52.62 7.02 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.444 0.535 . . . . 71.41 112.444 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 133.09 -103.92 0.52 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 75.21 113.546 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 65.41 -110.29 3.4 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.464 -0.398 . . . . 72.22 113.638 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . 0.577 ' HB3' ' HB2' ' A' ' 151' ' ' HIS . 12.2 p-80 58.38 130.16 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.629 1.172 . . . . 64.12 113.218 -179.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -160.04 131.33 5.89 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.627 -0.715 . . . . 75.44 110.829 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -155.37 134.44 12.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.812 0.671 . . . . 73.42 112.812 -178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 22.1 p-80 -141.46 153.52 45.02 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.344 -0.389 . . . . 72.23 110.325 172.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -136.41 -179.88 5.95 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.691 0.626 . . . . 72.44 112.691 -170.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.423 ' HE2' HG11 ' A' ' 89' ' ' VAL . 11.9 m-70 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 118.641 -0.695 . . . . 64.42 111.278 177.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.867 0.365 . . . . 61.31 111.395 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.48 156.57 22.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.356 0.598 . . . . 64.13 112.256 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.43 163.94 24.39 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.633 0.605 . . . . 62.03 112.633 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.08 -40.01 60.57 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.532 0.682 . . . . 72.02 110.5 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -58.05 -38.7 76.79 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 115.487 -0.779 . . . . 71.31 111.692 176.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -67.53 -41.18 84.77 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.522 -0.308 . . . . 73.22 110.581 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -53.94 -51.45 63.78 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.769 0.318 . . . . 65.44 111.439 176.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.68 -52.73 59.35 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.056 0.391 . . . . 63.31 112.056 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -57.83 -43.17 85.64 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.283 -0.417 . . . . 73.03 111.389 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 36.3 tp -62.21 -41.78 98.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.55 -0.296 . . . . 73.51 111.673 177.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -59.25 -51.61 69.22 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.897 0.379 . . . . 64.42 111.412 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.89 -52.51 48.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.201 0.524 . . . . 74.44 111.486 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.18 -42.39 88.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.921 -0.581 . . . . 74.3 111.825 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 t -59.62 -49.59 77.18 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.63 0.252 . . . . 64.45 111.587 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.459 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 67.1 mtt180 -59.23 -48.1 82.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.871 0.367 . . . . 62.5 110.685 177.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.406 ' HH ' ' HA3' ' A' ' 48' ' ' GLY . 57.5 t80 -56.82 -54.96 40.37 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.257 -0.429 . . . . 74.11 112.055 -177.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.34 -40.21 81.55 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.791 0.293 . . . . 74.33 111.791 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -63.47 -57.5 10.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 111.907 0.336 . . . . 74.15 111.907 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.2 mm-40 -66.66 -31.32 71.93 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.937 0.399 . . . . 72.34 111.828 -177.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -76.36 -34.48 58.92 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.632 0.253 . . . . 73.24 111.423 179.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.93 -34.54 71.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.168 0.509 . . . . 43.25 110.982 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.73 ' HA ' ' HZ3' ' A' ' 110' ' ' LYS . 79.3 p -86.95 -22.33 25.68 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.08 -0.509 . . . . 75.43 111.794 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.98 38.5 48.28 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 121.319 -0.467 . . . . 55.13 112.712 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.3 -161.9 1.27 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.143 0.497 . . . . 73.41 111.909 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -148.76 128.5 13.32 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.209 -0.45 . . . . 74.25 110.903 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.4 ' CG ' ' HZ1' ' A' ' 28' ' ' LYS . 5.5 p-10 -88.02 176.33 7.36 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.038 0.447 . . . . 73.35 111.139 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -130.99 26.31 4.93 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.104 0.478 . . . . 61.04 111.505 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.4 ' HZ1' ' CG ' ' A' ' 26' ' ' ASP . 38.2 mtmm -71.46 137.93 83.65 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-O 120.8 0.333 . . . . 73.31 111.708 -178.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 134.6 64.6 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.552 2.168 . . . . 73.03 111.879 176.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.468 ' HE3' HD23 ' A' ' 41' ' ' LEU . 3.0 tpt -73.0 153.6 40.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.899 0.38 . . . . 64.35 111.327 -175.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.76 -167.32 1.44 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 115.33 0.892 . . . . 71.05 115.33 -174.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -53.48 -30.44 40.97 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.861 1.06 . . . . 75.01 113.861 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.446 ' OG ' ' HB2' ' A' ' 37' ' ' SER . 85.7 p -79.84 -12.42 59.76 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.287 0.477 . . . . 64.22 112.287 -177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 61.48 -116.39 9.28 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 116.161 -0.472 . . . . 55.13 113.505 176.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.89 -38.35 70.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.464 0.542 . . . . 54.33 112.464 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.464 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 25.1 m -58.98 -48.07 82.87 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.971 0.415 . . . . 73.03 111.82 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.446 ' HB2' ' OG ' ' A' ' 33' ' ' SER . 35.4 t -64.88 -43.14 93.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.972 0.415 . . . . 70.11 111.065 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -60.84 -54.7 41.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.267 -0.424 . . . . 65.24 112.142 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.495 ' HG3' HG22 ' A' ' 147' ' ' VAL . 20.8 ptmt -56.03 -41.85 75.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.559 0.218 . . . . 74.01 111.054 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.05 87.77 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.766 0.317 . . . . 73.14 111.524 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.468 HD23 ' HE3' ' A' ' 30' ' ' MET . 60.4 tp -58.85 -54.7 44.18 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.524 0.565 . . . . 64.0 112.524 -178.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.05 -27.75 63.87 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.105 -0.372 . . . . 64.42 111.756 -176.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.474 HG23 HG23 ' A' ' 152' ' ' VAL . 46.8 m -62.75 -45.19 93.86 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 120.827 0.346 . . . . 73.35 110.135 171.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -54.57 -34.65 62.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.29 -0.414 . . . . 73.52 111.719 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -70.73 -52.21 22.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.785 0.326 . . . . 72.41 110.945 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -58.85 -44.27 90.95 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.15 -0.477 . . . . 74.13 112.164 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 43' ' ' THR . 19.5 m -87.98 -33.05 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 120.948 0.404 . . . . 73.0 111.942 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.406 ' HA3' ' HH ' ' A' ' 16' ' ' TYR . . . -68.02 -30.34 74.0 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 114.229 0.451 . . . . 61.12 114.229 -174.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.511 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 29.6 t70 -58.42 -57.61 12.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 117.568 0.684 . . . . 75.21 111.277 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.07 -42.08 98.3 Favored Glycine 0 CA--C 1.526 0.763 0 C-N-CA 121.353 -0.451 . . . . 55.2 113.006 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 77.0 t -57.52 -45.47 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 122.593 -0.357 . . . . 73.15 111.067 176.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -61.27 -43.86 98.19 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.76 -0.2 . . . . 73.13 111.22 175.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.511 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 4.3 mmp_? -57.25 -49.4 76.16 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.826 0.346 . . . . 75.24 111.494 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -66.17 -47.65 73.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.155 0.502 . . . . 64.2 111.637 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -73.05 -20.69 60.93 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.943 -0.571 . . . . 71.14 112.453 -176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -49.1 -54.59 15.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.324 0.491 . . . . 74.21 112.324 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 t -53.24 -36.73 61.39 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.419 0.525 . . . . 75.33 112.419 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.08 14.81 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.014 0.435 . . . . 53.31 111.538 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -60.04 -36.57 77.57 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.342 -0.39 . . . . 73.24 111.882 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.528 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 70.7 mm-40 -47.13 -50.99 19.17 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 120.985 0.421 . . . . 53.24 111.254 176.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.78 -35.47 67.98 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.098 -0.501 . . . . 75.44 113.208 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 45.0 mtm -77.15 -44.59 29.75 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 122.301 -0.529 . . . . 60.24 111.143 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.429 HD13 HG21 ' A' ' 105' ' ' VAL . 9.1 mp -54.88 -27.73 44.96 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.132 -0.355 . . . . 72.11 111.416 176.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.528 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 99.4 mtt180 -65.02 -44.72 88.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.749 0.309 . . . . 73.24 111.562 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.69 -7.07 55.42 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.344 0.498 . . . . 70.34 112.344 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 96.1 mt -96.35 -71.66 0.67 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.052 0.453 . . . . 74.04 111.209 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t0 47.46 88.85 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.248 -0.887 . . . . 72.32 111.838 -172.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.5 HG21 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -73.22 103.09 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.914 -0.584 . . . . 64.23 111.053 -178.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.429 ' HD3' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.09 -11.3 16.66 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.101 0.408 . . . . 75.03 112.101 -179.294 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.429 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 1.2 p30 -154.42 176.79 11.91 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.024 0.44 . . . . 72.52 111.978 178.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.1 -39.72 79.36 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.163 -0.471 . . . . 74.12 112.119 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -56.1 -39.87 72.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.483 -0.326 . . . . 73.04 111.747 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.5 ' HB2' HG21 ' A' ' 68' ' ' ILE . 50.8 m-20 -62.23 -39.12 91.76 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.938 0.399 . . . . 73.41 110.711 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.423 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 82.2 t -60.87 -46.8 95.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.206 0.526 . . . . 65.35 110.927 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 78' ' ' SER . 99.7 mttt -65.91 -28.78 69.19 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.889 0.376 . . . . 62.54 111.186 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.9 m -67.55 -36.48 81.04 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.791 0.329 . . . . 51.12 110.492 171.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.7 mt -59.44 -39.98 85.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.668 0.27 . . . . 74.43 110.617 173.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 28.9 t -52.46 -37.02 56.07 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.96 0.409 . . . . 44.5 111.225 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -61.37 -47.27 86.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.947 0.403 . . . . 64.15 110.361 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.448 ' O ' HG21 ' A' ' 84' ' ' VAL . 59.7 t -60.89 -42.86 94.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.263 -0.426 . . . . 75.31 110.892 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.533 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -54.54 -44.14 72.57 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.238 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 78' ' ' SER . 74.9 mt -61.79 -36.9 76.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.146 0.498 . . . . 64.12 111.137 176.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.444 ' HA ' ' OG ' ' A' ' 86' ' ' SER . 82.6 m-70 -71.65 -27.47 63.1 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.073 0.397 . . . . 64.53 112.073 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.448 HG21 ' O ' ' A' ' 80' ' ' VAL . 94.1 t -58.82 -23.84 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 N-CA-C 111.994 0.368 . . . . 73.25 111.994 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.456 ' CE2' HD22 ' A' ' 98' ' ' LEU . 58.0 m-85 -106.5 9.44 31.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.437 0.532 . . . . 65.25 112.437 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.444 ' OG ' ' HA ' ' A' ' 83' ' ' HIS . 59.2 m -73.52 -5.13 38.22 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.034 0.445 . . . . 70.24 111.863 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.54 -26.08 67.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.393 -0.367 . . . . 61.4 111.986 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.86 86.63 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 121.274 -0.489 . . . . 37.75 114.012 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.0 m -80.77 159.46 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.409 -0.465 . . . . 73.23 111.851 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.1 p -95.17 -4.1 46.64 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 112.2 0.445 . . . . 62.1 112.2 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.71 118.97 5.4 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.563 0.579 . . . . 72.41 112.563 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -67.12 -19.42 65.62 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.285 0.476 . . . . 74.41 112.285 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.47 -27.81 54.61 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 120.978 -0.63 . . . . 70.24 113.506 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.9 mtp85 -65.8 -25.64 67.33 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.52 -0.4 . . . . 74.44 112.0 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.4 mm -57.03 -40.75 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 121.247 0.546 . . . . 71.43 110.16 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.42 -41.45 88.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 116.031 -0.531 . . . . 64.32 110.886 176.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.6 m -57.86 -44.26 86.48 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.859 0.361 . . . . 64.04 111.233 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.456 HD22 ' CE2' ' A' ' 85' ' ' PHE . 31.5 tp -61.39 -54.94 37.19 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.184 0.516 . . . . 70.11 111.693 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.37 -37.01 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.136 -0.484 . . . . 75.1 112.193 -176.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.6 p -64.05 -41.88 97.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.653 -0.249 . . . . 72.45 111.282 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 105' ' ' VAL . 16.0 t80 -60.17 -43.48 95.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.921 0.391 . . . . 73.45 110.577 175.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.72 -46.42 92.26 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.969 -0.634 . . . . 51.31 112.552 174.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.13 80.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.941 0.401 . . . . 71.33 111.682 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -65.59 -47.98 73.9 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.267 -0.424 . . . . 70.04 111.025 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 101' ' ' PHE . 41.6 t -64.92 -34.24 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.93 0.395 . . . . 74.33 110.546 176.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.09 -39.91 79.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.134 -0.485 . . . . 65.53 111.405 176.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.25 -46.2 83.26 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.15 0.5 . . . . 72.24 110.906 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -62.3 -35.8 80.14 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.988 -0.551 . . . . 73.04 110.937 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 117' ' ' SER . 98.4 mt -65.29 -45.0 86.18 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.259 -0.428 . . . . 73.42 111.198 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.73 ' HZ3' ' HA ' ' A' ' 22' ' ' THR . 84.1 tttt -57.53 -43.57 84.46 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.534 0.207 . . . . 62.41 111.081 177.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.5 m -54.65 -48.42 72.34 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.988 0.423 . . . . 73.24 111.505 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.8 pt -90.02 17.53 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 112.159 0.429 . . . . 64.23 112.159 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 67.69 9.11 6.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.701 1.0 . . . . 74.13 113.701 174.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.52 43.56 1.12 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.83 -0.544 . . . . 61.3 111.76 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.15 -28.98 70.03 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 122.167 -0.333 . . . . 65.32 111.655 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.0 m -56.41 -27.76 57.41 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.764 0.316 . . . . 73.31 111.499 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.52 ' HB2' HD11 ' A' ' 109' ' ' LEU . 43.9 m -74.43 -26.78 60.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.107 0.41 . . . . 65.12 112.107 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.93 -45.43 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 112.994 0.739 . . . . 62.34 112.994 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.84 -51.48 19.89 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.659 0.615 . . . . 73.41 112.659 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.28 -28.69 85.38 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.638 1.559 . . . . 75.14 111.936 172.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.04 -45.02 82.93 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 109.539 -0.541 . . . . 72.15 109.539 173.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.18 82.99 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.057 0.456 . . . . 71.15 110.905 173.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -66.23 -32.56 74.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.365 -0.38 . . . . 64.51 111.013 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.1 m -65.01 -46.25 82.16 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.946 0.403 . . . . 64.45 110.863 175.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.407 HG22 ' HG ' ' A' ' 98' ' ' LEU . 45.1 mm -56.26 -50.76 69.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.427 0.632 . . . . 74.3 110.642 175.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.2 m -64.24 -41.2 97.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.399 -0.819 . . . . 55.22 111.748 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.1 t70 -60.65 -52.01 66.95 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.542 -0.299 . . . . 65.2 110.692 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.493 HG23 ' HB2' ' A' ' 81' ' ' MET . 93.2 t -58.04 -44.63 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 121.113 0.482 . . . . 73.25 111.252 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.56 ' HG ' HD11 ' A' ' 137' ' ' LEU . 14.0 tp -55.35 -51.98 65.01 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.4 0.619 . . . . 64.14 110.85 178.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.414 HG11 ' HB2' ' A' ' 134' ' ' ARG . 90.3 t -75.5 -26.38 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.728 -0.669 . . . . 54.05 112.032 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.3 tpp180 -61.46 -35.27 77.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.924 0.392 . . . . 73.01 111.969 -176.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.494 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.7 t -121.79 -33.19 3.62 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.801 0.667 . . . . 63.11 112.801 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.494 ' HG2' HG23 ' A' ' 132' ' ' THR . 46.4 mmtm -114.72 20.53 15.17 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.262 0.838 . . . . 73.3 113.262 -172.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.414 ' HB2' HG11 ' A' ' 130' ' ' VAL . 44.1 ttp180 -56.41 -51.67 67.49 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.089 0.471 . . . . 71.43 111.637 177.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.66 -47.33 84.81 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.922 -0.581 . . . . 71.11 111.123 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -61.67 -37.15 83.02 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 111.611 0.226 . . . . 71.51 111.611 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.56 HD11 ' HG ' ' A' ' 129' ' ' LEU . 20.7 mt -58.29 -48.07 81.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.645 -0.252 . . . . 73.34 111.672 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.6 p -78.34 -39.66 24.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 112.161 0.43 . . . . 74.42 112.161 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -67.03 -49.7 64.4 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.413 0.523 . . . . 73.14 112.413 -177.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -94.6 -1.35 53.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.698 0.285 . . . . 75.33 111.482 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.544 ' HD3' ' HB3' ' A' ' 161' ' ' HIS . 19.6 mtp180 55.63 79.02 0.17 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.406 0.622 . . . . 75.32 111.078 -177.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -54.47 -53.28 39.46 Favored Glycine 0 C--N 1.335 0.478 0 CA-C-N 115.244 -0.889 . . . . 64.31 114.28 -173.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -65.55 -40.03 92.38 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.132 0.466 . . . . 75.24 111.88 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 6.4 m-20 -62.2 -58.55 7.34 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.829 0.347 . . . . 75.12 110.866 175.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -59.02 -31.19 68.04 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 121.329 -0.462 . . . . 45.22 112.831 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -58.88 -55.73 31.34 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.167 0.508 . . . . 74.12 111.119 175.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.495 HG22 ' HG3' ' A' ' 39' ' ' LYS . 93.5 t -63.85 -36.83 77.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 116.147 -0.479 . . . . 64.51 111.568 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 55.1 mt-10 -66.82 -39.14 87.58 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.93 0.395 . . . . 73.34 111.236 176.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -61.32 -48.97 78.9 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.903 0.383 . . . . 73.32 111.788 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.46 -22.53 35.16 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.011 0.374 . . . . 63.44 112.011 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.1 t60 61.08 88.16 0.09 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.524 0.678 . . . . 74.31 111.044 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 43' ' ' THR . 76.8 t -129.79 -74.93 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 115.717 -0.674 . . . . 62.12 110.689 178.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.469 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 62.7 mm-40 -116.41 79.82 1.37 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.387 0.613 . . . . 73.33 111.563 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -150.52 176.89 10.54 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.684 -0.689 . . . . 74.21 109.903 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.558 HD11 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -124.99 -17.25 5.84 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.869 0.692 . . . . 64.23 112.869 -176.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 62.18 -1.43 0.39 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.362 0.875 . . . . 73.45 113.362 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -76.87 77.87 1.44 Allowed Glycine 0 CA--C 1.524 0.622 0 C-N-CA 121.077 -0.582 . . . . 72.24 112.206 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 107.65 -153.88 16.71 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 112.004 -0.438 . . . . 72.45 112.004 -175.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -167.1 125.66 1.34 Allowed 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.009 0.433 . . . . 71.24 111.565 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -78.05 29.18 0.17 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 120.874 0.368 . . . . 72.43 111.827 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . 0.544 ' HB3' ' HD3' ' A' ' 141' ' ' ARG . 3.3 p-80 -172.1 132.94 0.68 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.911 0.484 . . . . 75.23 110.96 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -89.49 99.9 12.8 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.356 0.598 . . . . 63.52 110.804 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -66.91 148.08 52.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.454 -0.794 . . . . 74.54 112.273 -173.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 3.3 p-80 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.807 -0.616 . . . . 74.31 111.172 176.208 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptm . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 112.267 0.469 . . . . 72.44 112.267 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.426 ' HB2' ' NE ' ' A' ' 7' ' ' ARG . 2.9 mp0 -98.98 169.54 9.36 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.573 0.701 . . . . 63.41 112.518 -174.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -94.96 155.42 16.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 115.34 -0.846 . . . . 74.52 108.873 170.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -61.28 -33.69 73.96 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.386 -0.821 . . . . 61.22 111.413 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.48 -35.39 75.78 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.088 0.47 . . . . 60.12 110.497 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -67.27 -36.15 81.0 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.046 -0.525 . . . . 74.23 110.24 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 4.4 mpt_? -61.98 -51.26 68.79 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.639 -0.255 . . . . 71.14 111.544 176.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.41 -48.01 83.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.018 0.437 . . . . 73.45 111.75 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 p -60.67 -52.81 63.57 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.389 -0.369 . . . . 53.24 111.344 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.9 tp -58.78 -35.96 73.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.008 0.433 . . . . 64.11 111.615 176.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 21.3 tt0 -59.27 -52.93 63.53 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.274 0.559 . . . . 75.31 110.619 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -63.85 -53.96 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 115.646 -0.707 . . . . 74.41 111.774 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.426 ' O ' HD11 ' A' ' 17' ' ' LEU . 82.8 mt -59.16 -49.85 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 112.17 0.433 . . . . 74.15 112.17 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.7 t -55.16 -50.26 69.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 120.853 0.359 . . . . 71.23 111.524 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.668 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 17.7 mtp180 -60.86 -42.78 98.54 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.636 -0.256 . . . . 72.1 111.593 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.402 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 85.1 t80 -58.48 -52.86 63.87 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.896 0.379 . . . . 75.42 111.765 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.426 HD11 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -54.47 -41.2 69.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.879 0.371 . . . . 60.35 111.581 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.432 ' NH2' ' HG3' ' A' ' 119' ' ' GLU . 19.4 mmt85 -65.2 -52.78 52.72 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.352 0.501 . . . . 65.23 112.352 178.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 11.2 pt-20 -62.39 -34.27 76.38 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.846 0.355 . . . . 75.13 111.955 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 33.3 mm-40 -69.64 -32.02 70.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.882 0.372 . . . . 73.11 111.208 176.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.52 -29.65 61.48 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.37 -0.377 . . . . 71.22 111.921 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.507 HG21 ' HE3' ' A' ' 110' ' ' LYS . 51.5 p -87.17 -30.43 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.826 0.346 . . . . 65.14 111.753 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.89 8.1 67.61 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 121.26 -0.495 . . . . 72.34 112.399 -176.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.97 124.42 8.3 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.797 0.332 . . . . 64.13 111.16 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.611 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -58.18 155.5 11.21 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.996 0.739 . . . . 74.45 112.996 -177.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -88.22 158.89 18.36 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.203 -0.453 . . . . 62.02 111.253 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.9 t -116.64 -0.35 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.715 0.635 . . . . 70.55 112.715 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -75.7 150.67 84.33 Favored Pre-proline 0 N--CA 1.473 0.708 0 O-C-N 122.172 -0.33 . . . . 73.12 111.784 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -53.59 140.79 64.91 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 122.478 2.119 . . . . 64.53 112.627 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.668 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 57.1 tpp -60.28 -71.08 0.14 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.119 0.414 . . . . 71.44 112.119 -176.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 157.37 -115.25 0.65 Allowed Glycine 0 CA--C 1.524 0.648 0 C-N-CA 121.122 -0.561 . . . . 72.0 112.614 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -80.87 -15.53 56.08 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 117.134 0.467 . . . . 75.3 111.88 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.507 ' OG ' ' HB3' ' A' ' 37' ' ' SER . 79.8 p -113.32 133.86 54.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.826 0.346 . . . . 71.12 111.13 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -107.37 -87.81 1.96 Allowed Glycine 0 CA--C 1.531 1.041 0 C-N-CA 121.024 -0.608 . . . . 74.23 113.93 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.48 -50.83 69.85 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.917 0.71 . . . . 62.41 112.917 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.8 m -57.77 -50.76 72.16 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.169 0.433 . . . . 72.02 112.169 -177.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.507 ' HB3' ' OG ' ' A' ' 33' ' ' SER . 79.8 p -57.78 -48.06 80.77 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.566 -0.288 . . . . 73.43 111.703 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.0 ttt-85 -52.97 -54.66 31.84 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.913 0.387 . . . . 71.44 111.288 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -55.86 -48.64 75.17 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.921 -0.582 . . . . 62.2 111.161 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.35 -41.34 98.84 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.273 -0.421 . . . . 71.22 111.829 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.497 HD22 ' HE2' ' A' ' 30' ' ' MET . 45.8 tp -64.24 -53.39 49.93 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 111.775 0.287 . . . . 73.34 111.775 -176.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -64.35 -31.34 72.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.771 0.32 . . . . 72.35 111.409 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.483 ' O ' HG22 ' A' ' 47' ' ' VAL . 86.2 m -67.17 -44.15 80.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.778 0.323 . . . . 71.54 110.57 174.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 39.2 mt -54.9 -44.19 73.93 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.495 0.554 . . . . 64.12 112.495 178.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -72.25 -37.54 69.09 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.538 0.57 . . . . 72.23 112.538 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.41 ' NH1' HG11 ' A' ' 152' ' ' VAL . 16.1 ptm180 -73.77 -41.36 62.56 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.965 -0.46 . . . . 73.13 111.814 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 43' ' ' THR . 17.2 m -79.11 -33.51 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.189 0.518 . . . . 73.22 110.734 176.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -59.68 -50.33 68.91 Favored Glycine 0 C--O 1.225 -0.451 0 CA-C-N 115.74 -0.664 . . . . 50.25 112.751 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -53.87 -46.59 71.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.898 0.349 . . . . 73.34 111.51 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.08 -48.41 79.87 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 121.14 -0.552 . . . . 73.22 112.9 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 70.9 t -63.52 -47.08 93.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.909 0.385 . . . . 73.0 111.378 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.5 mt-30 -55.18 -47.41 75.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.197 -0.456 . . . . 74.42 111.595 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -57.81 -42.0 83.35 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.11 0.781 . . . . 73.24 113.11 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -84.87 -27.58 26.59 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.821 -0.549 . . . . 70.32 111.906 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -90.72 -18.21 25.41 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.221 0.823 . . . . 75.15 113.221 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.463 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 31.7 tt0 -49.15 -51.12 34.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.862 0.689 . . . . 71.31 112.862 -170.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.71 -35.51 70.75 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.051 0.453 . . . . 53.12 111.655 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.05 -49.59 49.69 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.267 -0.424 . . . . 73.55 111.615 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.92 -40.8 98.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.697 0.258 . . . . 74.25 111.697 178.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.579 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 74.7 mm-40 -51.34 -44.7 62.09 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.597 0.237 . . . . 72.41 111.131 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.435 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -51.85 -38.72 46.32 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.229 -0.51 . . . . 61.24 112.826 176.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.434 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 84.9 mtp -73.3 -43.21 61.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 54.52 111.121 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -57.46 -29.36 64.14 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.15 0.426 . . . . 75.23 112.15 178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.579 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 53.8 mtm180 -64.51 -10.99 29.43 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.621 0.6 . . . . 74.05 112.621 -178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -122.3 -0.74 9.29 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.009 0.433 . . . . 73.4 111.424 173.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.1 mt -97.12 -78.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.385 -0.37 . . . . 75.15 110.889 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 68.11 -47.93 0.53 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.161 1.171 . . . . 74.13 114.161 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.434 ' N ' HD13 ' A' ' 68' ' ' ILE . 2.2 mp 65.58 114.82 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.7 0.8 . . . . 75.03 111.938 -177.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -114.54 -5.41 12.8 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.286 -0.416 . . . . 72.0 111.717 176.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.489 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -170.46 175.84 4.62 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.714 0.292 . . . . 65.53 111.341 172.615 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.526 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 37.8 tt0 -58.21 -24.04 57.82 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.995 0.369 . . . . 72.33 111.995 -178.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.411 ' HB3' HD22 ' A' ' 70' ' ' ASN . 36.9 t70 -56.01 -45.25 79.14 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.782 0.325 . . . . 71.33 111.016 176.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -63.6 -41.28 98.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.113 0.483 . . . . 65.34 110.412 175.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.0 t -56.74 -43.57 79.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 115.997 -0.547 . . . . 73.31 111.323 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 71' ' ' GLU . 65.3 mttm -60.15 -39.66 87.14 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.293 0.568 . . . . 74.1 110.564 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.1 t -66.79 -33.12 74.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.974 -0.557 . . . . 75.54 110.969 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.448 ' O ' ' HG2' ' A' ' 81' ' ' MET . 85.4 mt -61.01 -37.28 81.98 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.72 0.295 . . . . 54.12 110.798 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.402 ' O ' HG13 ' A' ' 82' ' ' ILE . 45.4 t -52.75 -41.22 63.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.998 0.427 . . . . 72.31 111.098 177.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.8 mmt85 -56.23 -44.58 79.7 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.164 0.507 . . . . 74.32 110.749 177.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.2 t -69.95 -41.08 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.782 -0.644 . . . . 70.14 111.392 178.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.448 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.5 mmt -55.54 -38.82 69.79 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.025 0.441 . . . . 71.14 111.605 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 78' ' ' SER . 70.9 mt -58.49 -40.72 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.248 0.547 . . . . 54.13 110.85 173.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.0 -25.8 60.09 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.912 -0.585 . . . . 64.45 112.47 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 94.9 t -54.0 -25.33 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-O 120.981 0.42 . . . . 75.31 111.709 175.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.591 ' HZ ' HD23 ' A' ' 98' ' ' LEU . 79.2 m-85 -94.87 10.61 34.69 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.474 0.546 . . . . 74.43 112.474 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.7 t -62.84 -10.55 13.6 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.629 0.603 . . . . 65.12 112.629 -176.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.67 -28.7 69.79 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.915 0.388 . . . . 63.42 111.675 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.82 -4.4 7.66 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.297 -0.478 . . . . 63.42 114.071 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.0 m -64.55 150.57 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 112.204 0.446 . . . . 75.34 112.204 -177.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 67.1 p -79.73 -34.37 40.04 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.832 0.349 . . . . 73.11 111.644 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.427 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 43.0 m-80 -50.68 151.75 2.27 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.011 -0.54 . . . . 73.42 112.416 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.549 ' HE3' HG13 ' A' ' 95' ' ' ILE . 90.9 m95 -81.35 3.15 25.31 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.756 0.65 . . . . 75.14 112.756 -175.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.24 -35.47 70.83 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 121.056 -0.592 . . . . 54.43 112.418 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 91' ' ' ASN . 23.2 ptt180 -56.12 -40.49 73.83 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.865 0.466 . . . . 74.21 111.603 173.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.549 HG13 ' HE3' ' A' ' 92' ' ' TRP . 40.1 mm -67.79 -44.95 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 120.937 0.399 . . . . 74.23 110.563 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.6 t -55.06 -46.32 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 116.099 -0.5 . . . . 74.53 111.118 176.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -58.78 -46.92 86.43 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 73.24 111.597 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.591 HD23 ' HZ ' ' A' ' 85' ' ' PHE . 26.2 tp -57.76 -55.02 40.23 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.213 0.53 . . . . 75.34 111.661 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.8 mt -69.19 -35.89 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.972 -0.558 . . . . 74.23 111.912 -174.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.8 p -68.19 -43.13 78.79 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.56 0.219 . . . . 65.14 111.172 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -63.18 -42.35 99.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.775 0.321 . . . . 75.42 111.101 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.91 -48.1 84.51 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.896 -0.668 . . . . 73.34 112.158 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.42 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.41 -32.49 74.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.152 0.501 . . . . 51.14 111.353 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.463 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 39.3 t80 -63.81 -47.5 80.63 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.895 -0.593 . . . . 73.22 110.832 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.97 -36.39 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.286 -0.416 . . . . 54.3 110.515 175.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.14 -42.5 69.61 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.279 -0.418 . . . . 73.11 111.759 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -56.68 -49.11 76.06 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.438 0.637 . . . . 73.22 110.706 175.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -61.18 -33.47 73.49 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.492 -0.776 . . . . 71.32 111.07 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.35 -49.57 54.36 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.429 -0.35 . . . . 70.14 111.869 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.507 ' HE3' HG21 ' A' ' 22' ' ' THR . 63.6 tttm -64.35 -33.55 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.723 0.297 . . . . 74.51 111.183 -179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 84.0 m -54.54 -44.02 72.46 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.167 0.508 . . . . 73.24 110.944 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.2 pt -95.43 31.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 116.104 -0.498 . . . . 75.11 111.528 176.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 9.3 p30 48.71 22.18 0.5 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.916 1.286 . . . . 64.31 114.224 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -93.61 35.98 1.1 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.122 0.487 . . . . 73.15 110.81 173.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -54.9 -29.17 55.3 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.093 -0.503 . . . . 74.22 112.022 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.415 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 80.6 p -58.63 -41.57 86.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.789 0.328 . . . . 75.55 111.075 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.6 t -59.17 -26.37 64.72 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 112.268 0.47 . . . . 72.01 112.268 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.6 mt -54.3 -37.77 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.478 0.547 . . . . 74.35 112.478 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.432 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 44.4 mt-10 -71.71 -52.88 7.75 Favored Pre-proline 0 CA--C 1.548 0.873 0 N-CA-C 112.418 0.525 . . . . 75.02 112.418 -176.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.415 ' HD2' ' O ' ' A' ' 116' ' ' SER . 12.0 Cg_endo -57.57 -30.01 87.04 Favored 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 121.629 1.553 . . . . 65.33 111.961 172.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.45 -44.55 86.9 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.906 -0.405 . . . . 70.24 109.906 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.7 -36.61 76.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.26 -0.427 . . . . 61.03 111.104 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.11 -43.7 98.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.574 -0.285 . . . . 64.34 110.655 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -60.86 -44.78 96.57 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 120.764 0.316 . . . . 65.53 111.415 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.9 mm -55.57 -52.43 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.448 0.642 . . . . 72.41 111.094 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.1 m -67.78 -34.9 77.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.387 -0.824 . . . . 75.23 111.604 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 10.2 t70 -62.95 -52.45 62.98 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.471 -0.331 . . . . 73.21 110.709 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.433 HG22 ' HB2' ' A' ' 81' ' ' MET . 90.0 t -58.21 -35.03 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.43 0.633 . . . . 75.13 111.002 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.563 ' HG ' HD11 ' A' ' 137' ' ' LEU . 22.4 tp -65.24 -53.57 42.43 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.724 -0.671 . . . . 62.01 111.205 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -77.99 -29.01 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 N-CA-C 112.414 0.524 . . . . 72.22 112.414 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 20.7 tpp180 -49.21 -40.3 33.04 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 112.564 0.579 . . . . 64.25 112.564 -174.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.653 HG21 ' HD3' ' A' ' 133' ' ' LYS . 1.3 t -130.64 -25.62 2.34 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.847 0.684 . . . . 64.43 112.847 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.653 ' HD3' HG21 ' A' ' 132' ' ' THR . 0.0 OUTLIER -95.6 17.55 14.62 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.65 -0.656 . . . . 73.41 111.968 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -45.41 -55.96 5.51 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.994 0.426 . . . . 75.14 111.894 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 5.3 m-20 -66.96 -50.62 61.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.223 -0.444 . . . . 63.52 111.163 -178.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -52.53 -36.74 56.11 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 111.967 0.358 . . . . 75.25 111.967 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.563 HD11 ' HG ' ' A' ' 129' ' ' LEU . 28.9 mt -57.58 -53.12 61.73 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.033 0.383 . . . . 72.1 112.033 177.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.5 p -77.16 -41.95 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 111.911 0.337 . . . . 74.32 111.911 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 75.4 mmtt -57.26 -49.88 74.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.995 0.426 . . . . 71.12 111.712 -179.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -95.17 2.42 55.02 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.016 0.376 . . . . 71.13 112.016 -177.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 57.7 mtt85 55.59 58.25 4.68 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.943 0.401 . . . . 74.53 111.382 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.3 -57.58 4.25 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 115.097 0.799 . . . . 62.33 115.097 -172.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -66.95 -26.26 66.74 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.402 0.519 . . . . 73.52 112.402 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.18 -51.22 7.68 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.871 0.367 . . . . 74.14 111.222 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.94 88.6 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 116.359 -0.382 . . . . 72.51 113.196 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -53.59 -47.38 70.19 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.109 0.481 . . . . 73.03 111.887 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.29 -46.96 95.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 116.08 -0.509 . . . . 51.13 112.007 -178.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.36 -27.15 61.33 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.08 0.4 . . . . 75.42 112.08 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -56.71 -48.99 76.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.909 0.385 . . . . 75.52 111.443 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.32 -14.83 52.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.012 0.434 . . . . 72.41 111.25 174.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . 0.453 ' HE1' ' HA ' ' A' ' 155' ' ' LEU . 44.9 t60 68.19 85.25 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.685 0.794 . . . . 54.43 112.07 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.41 HG11 ' NH1' ' A' ' 46' ' ' ARG . 64.7 t -124.02 -71.41 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 CA-C-N 115.793 -0.639 . . . . 72.14 111.247 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -106.81 67.71 0.72 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.075 0.464 . . . . 72.42 110.355 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -169.72 -167.06 0.63 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.859 -0.609 . . . . 72.3 111.122 -176.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.518 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -147.93 11.56 0.95 Allowed 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.299 -0.41 . . . . 74.13 111.725 175.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.492 ' HG2' HD22 ' A' ' 155' ' ' LEU . 16.5 mm-40 -109.52 -11.92 14.75 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.341 0.497 . . . . 72.2 112.341 -175.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.31 99.58 0.25 Allowed Glycine 0 CA--C 1.527 0.843 0 C-N-CA 121.494 -0.384 . . . . 72.4 113.688 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -76.12 62.59 2.94 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.434 -0.412 . . . . 37.0 113.255 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.06 116.15 8.36 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.216 0.45 . . . . 73.11 112.216 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -112.28 -54.98 2.57 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.441 -0.345 . . . . 73.45 111.188 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -120.2 108.47 14.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.855 0.36 . . . . 74.31 111.253 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -87.63 130.01 34.92 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.929 0.395 . . . . 72.35 111.824 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -106.63 170.9 7.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.344 -0.389 . . . . 70.41 110.784 174.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 20.4 p80 . . . . . 0 C--O 1.258 1.519 0 N-CA-C 112.02 0.378 . . . . 75.31 112.02 178.667 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 ptm . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.26 0.553 . . . . 75.12 111.137 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -107.49 149.96 27.35 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.857 0.361 . . . . 71.54 111.943 -174.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -68.91 148.54 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.863 0.363 . . . . 63.23 111.045 172.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -59.09 -30.61 68.21 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.036 0.446 . . . . 74.14 110.535 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.417 HD22 ' HB ' ' A' ' 138' ' ' VAL . 58.5 tp -61.91 -43.52 98.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.105 -0.498 . . . . 72.54 110.859 173.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -63.19 -48.58 77.73 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.335 -0.393 . . . . 74.31 110.669 178.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -58.71 -39.35 80.54 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.943 0.349 . . . . 72.33 111.943 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.493 ' NE2' ' HB2' ' A' ' 33' ' ' SER . 7.9 tp60 -63.73 -52.39 60.69 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 74.12 111.02 176.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 m -59.43 -46.09 89.71 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.024 -0.534 . . . . 72.11 111.197 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.0 tp -61.75 -38.98 89.99 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.949 -0.568 . . . . 73.44 111.476 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.44 -51.25 70.19 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.329 0.585 . . . . 65.24 110.892 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.5 mt -61.45 -54.32 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.542 -0.754 . . . . 72.22 111.597 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.1 mt -64.13 -46.28 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 116.031 -0.531 . . . . 71.13 112.097 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -56.99 -52.12 66.53 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.768 0.318 . . . . 74.43 111.727 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.51 ' HD2' ' HE1' ' A' ' 30' ' ' MET . 48.5 mtt180 -66.19 -32.61 74.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.727 0.269 . . . . 73.4 111.727 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -62.63 -54.66 36.24 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 122.101 -0.375 . . . . 75.54 110.849 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -55.66 -45.01 77.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.699 0.285 . . . . 74.11 111.343 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -62.64 -63.35 1.25 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.478 0.547 . . . . 71.31 112.478 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 65.2 mm-40 -58.25 -34.86 70.93 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 112.649 0.611 . . . . 74.2 112.649 -174.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -80.33 -27.55 38.36 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.9 -0.5 . . . . 71.35 111.913 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.5 -33.75 69.52 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.151 0.501 . . . . 61.44 110.874 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.8 p -87.31 -30.31 20.94 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.021 -0.536 . . . . 63.32 111.418 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.98 19.59 46.44 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 121.302 -0.475 . . . . 61.14 112.644 -178.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -98.92 -167.14 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.424 0.631 . . . . 74.33 112.337 -177.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -148.06 146.1 28.72 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 75.24 110.799 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -105.58 159.87 15.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.313 0.578 . . . . 75.0 111.8 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.5 t -147.27 37.59 0.94 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.643 0.735 . . . . 62.01 110.577 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.444 ' HB3' ' HD2' ' A' ' 29' ' ' PRO . 64.0 mttm -128.23 165.02 33.68 Favored Pre-proline 0 N--CA 1.472 0.673 0 CA-C-N 115.849 -0.614 . . . . 55.24 111.701 -173.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.444 ' HD2' ' HB3' ' A' ' 28' ' ' LYS . 61.8 Cg_endo -75.16 148.46 34.69 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.324 2.016 . . . . 64.35 111.582 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.531 ' SD ' HD21 ' A' ' 41' ' ' LEU . 77.0 mtp -126.09 133.37 51.68 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.303 0.853 . . . . 74.31 113.303 -171.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 58.57 -150.69 34.15 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 114.941 0.736 . . . . 74.3 114.941 172.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -79.77 -53.39 6.84 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.913 0.387 . . . . 75.24 110.9 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.493 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 14.6 m -91.22 87.66 6.6 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.887 0.375 . . . . 70.3 110.238 175.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -53.91 -58.82 11.18 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 115.792 -0.64 . . . . 74.14 114.052 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.612 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -58.6 -51.4 70.05 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.879 0.325 . . . . 63.42 111.879 -177.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.9 m -57.86 -38.79 76.33 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.825 0.345 . . . . 71.21 111.604 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 23.0 t -65.12 -51.33 61.93 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.448 -0.342 . . . . 52.11 111.319 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -58.67 -45.97 88.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.576 -0.284 . . . . 72.43 111.592 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.612 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 18.1 mtpp -56.08 -48.32 76.32 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.936 0.398 . . . . 74.12 110.969 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.94 -43.65 98.41 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.36 -0.382 . . . . 63.52 111.447 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.531 HD21 ' SD ' ' A' ' 30' ' ' MET . 55.9 tp -59.42 -53.32 59.57 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.158 0.429 . . . . 75.41 112.158 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.91 -31.47 71.27 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.234 -0.291 . . . . 43.21 111.655 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.51 HG23 HG21 ' A' ' 152' ' ' VAL . 98.6 m -64.89 -43.01 94.3 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.814 0.34 . . . . 73.31 110.266 173.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.1 mt -54.12 -39.03 66.07 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.389 -0.369 . . . . 71.11 111.185 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -67.96 -45.8 73.2 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.765 0.317 . . . . 72.32 111.626 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.1 ttm-85 -61.0 -45.29 95.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.376 0.51 . . . . 74.11 112.376 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.3 m -87.52 -33.74 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.073 0.463 . . . . 72.33 111.321 178.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.401 ' HA2' ' HB ' ' A' ' 51' ' ' VAL . . . -69.44 -23.58 76.43 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.298 -0.477 . . . . 63.44 113.634 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.64 -53.78 34.99 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 117.183 0.492 . . . . 60.32 110.911 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.29 -44.38 28.51 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.061 -0.518 . . . . 62.04 113.017 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.401 ' HB ' ' HA2' ' A' ' 48' ' ' GLY . 76.8 t -57.29 -46.06 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 112.527 0.565 . . . . 73.33 112.527 -176.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.425 ' HG2' ' HG ' ' A' ' 100' ' ' SER . 75.1 mt-30 -57.31 -44.2 83.95 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 122.11 -0.369 . . . . 73.34 111.274 178.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -67.42 -54.11 23.21 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.47 0.545 . . . . 74.4 112.47 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -70.58 -20.06 62.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.208 0.447 . . . . 74.41 112.208 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.537 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 64.3 m-70 -90.3 -26.23 20.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.269 -0.269 . . . . 65.11 111.468 171.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.595 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 35.4 tt0 -53.08 -55.43 23.96 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.87 0.367 . . . . 70.24 111.518 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -56.4 -28.18 58.56 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.225 -0.443 . . . . 63.02 111.902 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.5 -44.63 20.86 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.904 0.383 . . . . 72.02 111.556 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.537 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.8 m-85 -70.8 -22.82 62.31 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.822 0.305 . . . . 65.35 111.822 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.449 ' NE2' ' HZ ' ' A' ' 104' ' ' PHE . 69.9 mm-40 -49.29 -35.88 19.28 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.966 0.412 . . . . 75.52 111.38 174.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.23 -30.43 70.83 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 121.267 -0.492 . . . . 60.42 112.988 177.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 72.8 mtm -89.11 -47.35 8.16 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.463 -0.433 . . . . 70.02 111.696 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.534 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 9.7 mp -56.85 -34.04 67.41 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.981 -0.449 . . . . 75.0 112.168 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -63.3 -17.42 62.52 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 120.831 0.348 . . . . 73.14 111.808 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -113.92 1.67 14.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.718 0.294 . . . . 72.42 111.145 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.534 ' HB2' ' HA ' ' A' ' 63' ' ' LEU . 91.2 mt -102.94 -73.97 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.516 0.327 . . . . 64.04 111.286 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 40.95 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.79 -0.641 . . . . 72.53 112.065 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.485 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.7 mp -59.6 104.99 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.715 -0.675 . . . . 64.32 112.161 -173.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.54 -4.99 15.21 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.757 -0.656 . . . . 52.24 112.173 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.417 HD21 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -159.04 169.57 23.99 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.02 0.438 . . . . 43.03 111.798 173.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.67 -36.72 69.91 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.732 0.641 . . . . 73.41 112.732 -175.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -55.19 -35.05 64.41 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 111.689 0.255 . . . . 74.45 111.689 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.468 ' HB3' HG13 ' A' ' 68' ' ' ILE . 67.6 m-20 -62.56 -42.69 99.7 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.904 0.383 . . . . 74.35 110.81 176.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.9 t -60.81 -43.05 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.171 0.51 . . . . 74.23 110.637 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -65.78 -29.47 69.97 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.227 -0.442 . . . . 74.31 111.112 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.5 m -68.42 -37.71 80.56 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.83 0.348 . . . . 75.15 110.586 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.513 ' O ' ' HG2' ' A' ' 81' ' ' MET . 98.5 mt -58.45 -33.14 69.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.36 -0.382 . . . . 64.43 111.194 175.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -52.27 -41.4 62.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.857 0.36 . . . . 71.42 111.591 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.62 -37.47 84.08 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.396 -0.366 . . . . 72.15 111.614 178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.61 -41.65 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.976 0.417 . . . . 45.43 110.942 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.513 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.3 mmt -55.02 -42.75 72.99 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.016 -0.538 . . . . 54.43 111.487 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 82.0 mt -58.54 -40.96 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.201 -0.454 . . . . 72.51 111.237 175.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -67.98 -26.83 66.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.18 0.437 . . . . 74.41 112.18 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.525 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 62.1 t -56.7 -25.37 21.39 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.149 0.499 . . . . 61.13 110.993 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.45 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.3 m-85 -92.56 5.0 52.48 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.808 0.67 . . . . 72.12 112.808 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.3 m -54.55 -34.14 61.33 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 112.118 0.414 . . . . 62.22 112.118 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.491 ' HB2' ' HD2' ' A' ' 94' ' ' ARG . 3.7 m-20 -78.7 -53.63 6.94 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.75 0.31 . . . . 74.2 111.317 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 58.64 61.88 6.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 116.445 -0.343 . . . . 73.34 113.686 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 m -100.54 149.58 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 112.6 0.593 . . . . 71.43 112.6 -176.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 32.3 p -66.32 -7.03 16.25 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.901 0.704 . . . . 70.0 112.901 -178.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -73.29 -15.75 61.4 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.953 0.353 . . . . 70.04 111.953 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.523 ' HE3' HG13 ' A' ' 95' ' ' ILE . 93.4 m95 64.52 3.16 1.81 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 122.823 0.449 . . . . 73.53 112.147 -176.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.42 -24.83 56.87 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.461 -0.4 . . . . 50.54 113.296 177.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.563 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 2.8 mmp_? -67.26 -33.04 74.47 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.462 -0.434 . . . . 75.54 111.255 176.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.523 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.1 mm -63.8 -46.11 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.303 0.573 . . . . 74.24 109.669 173.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -57.59 -44.43 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.704 -0.68 . . . . 64.44 110.904 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.0 m -61.57 -44.85 96.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.324 -0.398 . . . . 72.31 111.259 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.575 ' HG ' HG22 ' A' ' 125' ' ' ILE . 41.9 tp -58.49 -54.92 41.65 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.236 0.541 . . . . 71.11 111.209 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.2 mt -65.65 -32.58 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 115.98 -0.555 . . . . 74.22 111.221 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.425 ' HG ' ' HG2' ' A' ' 52' ' ' GLN . 29.6 t -64.36 -48.46 75.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 116.503 -0.317 . . . . 75.33 111.449 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.429 ' O ' HG22 ' A' ' 105' ' ' VAL . 14.3 t80 -61.39 -43.13 99.39 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.84 0.353 . . . . 74.33 110.582 177.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.73 -44.51 95.74 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 120.932 -0.652 . . . . 73.45 112.481 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.36 94.22 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.689 0.28 . . . . 44.25 111.484 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.595 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 16.0 t80 -64.83 -45.53 85.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.805 0.336 . . . . 74.32 111.429 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.543 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.7 t -64.42 -37.94 81.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 121.973 -0.454 . . . . 74.14 110.023 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . 0.403 ' HA ' HD13 ' A' ' 109' ' ' LEU . . . -61.15 -50.69 72.16 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.338 0.496 . . . . 74.34 112.338 179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.69 -35.59 76.67 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.15 -0.344 . . . . 73.1 111.004 178.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.427 ' O ' HG12 ' A' ' 112' ' ' ILE . 86.6 t60 -68.05 -35.28 77.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.751 0.31 . . . . 70.52 110.627 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 85.7 mt -60.77 -49.47 77.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.654 -0.248 . . . . 73.12 111.057 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -62.79 -38.19 89.68 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.789 0.328 . . . . 73.41 110.93 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 99.6 m -53.6 -38.33 63.88 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.126 0.489 . . . . 73.02 111.084 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.427 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -103.59 19.5 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 116.361 -0.382 . . . . 72.41 111.921 177.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 57.03 59.17 3.57 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.324 0.583 . . . . 70.24 112.396 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -131.17 33.89 4.08 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.915 -0.584 . . . . 74.21 110.984 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.77 -33.23 66.41 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.518 0.562 . . . . 74.31 112.518 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.0 m -54.98 -27.28 42.78 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 120.791 0.329 . . . . 74.51 111.606 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.0 t -79.18 -27.18 42.61 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.022 0.379 . . . . 42.4 112.022 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.64 -45.14 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 112.807 0.669 . . . . 70.23 112.807 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.76 -53.32 44.44 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 112.712 0.634 . . . . 65.42 112.712 -176.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.34 -27.23 82.74 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 121.598 1.532 . . . . 61.51 112.216 174.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -66.08 -44.43 84.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.362 -0.607 . . . . 74.43 109.362 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.11 -37.85 81.24 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.134 -0.485 . . . . 60.51 110.842 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.85 -40.03 93.91 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.221 -0.445 . . . . 64.45 110.79 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 61.6 m -62.96 -45.42 92.51 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.787 0.327 . . . . 73.2 111.246 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.575 HG22 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.7 -52.31 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 121.5 0.667 . . . . 74.35 110.669 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -68.24 -33.46 74.43 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.225 -0.898 . . . . 61.44 111.582 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 31.1 t70 -65.05 -51.97 58.47 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.744 -0.207 . . . . 75.42 111.282 -176.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 89.3 t -59.8 -41.92 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.275 0.56 . . . . 63.4 110.549 176.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.548 ' HG ' HD13 ' A' ' 137' ' ' LEU . 55.0 tp -55.97 -53.34 58.13 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.51 -0.768 . . . . 60.24 111.611 176.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 68.8 t -75.25 -26.52 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 115.902 -0.59 . . . . 73.53 111.843 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.424 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 18.7 tpt180 -57.31 -37.32 72.31 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.005 0.372 . . . . 72.53 112.005 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.6 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.7 t -125.07 -38.68 2.3 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.82 0.674 . . . . 72.15 112.82 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.6 ' HG2' HG23 ' A' ' 132' ' ' THR . 33.0 mmtp -105.04 20.01 19.61 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.767 0.654 . . . . 53.34 112.767 -173.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 46.6 ttp180 -54.68 -54.27 43.96 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.232 0.539 . . . . 65.12 111.365 176.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -53.25 -44.81 68.43 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.533 -0.758 . . . . 72.41 111.659 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -62.38 -38.22 88.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 111.776 0.287 . . . . 72.11 111.776 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.548 HD13 ' HG ' ' A' ' 129' ' ' LEU . 40.9 mt -56.44 -50.07 72.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.614 0.245 . . . . 72.43 111.605 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . 0.417 ' HB ' HD22 ' A' ' 5' ' ' LEU . 8.1 p -77.19 -43.46 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 112.101 0.408 . . . . 72.0 112.101 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -62.36 -60.34 3.69 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.962 0.411 . . . . 71.54 111.808 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -81.97 -2.99 53.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.606 -0.27 . . . . 72.3 111.648 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 70.9 mtt180 57.14 61.76 2.45 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.181 -0.463 . . . . 71.24 110.836 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -51.21 -45.1 52.29 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.703 -0.68 . . . . 74.01 114.635 -173.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -72.85 -23.81 60.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.363 0.581 . . . . 74.12 111.786 -176.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -81.74 -47.37 13.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.301 0.572 . . . . 75.12 110.215 173.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.421 ' HA2' ' CG ' ' A' ' 148' ' ' GLU . . . -62.84 -30.71 77.99 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.778 -0.646 . . . . 37.73 113.369 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -58.76 -40.56 84.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.997 0.427 . . . . 64.14 111.58 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 48.6 t -73.57 -41.75 55.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.307 -0.406 . . . . 74.14 112.056 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.424 ' HB2' ' HB2' ' A' ' 160' ' ' HIS . 0.0 OUTLIER -73.39 -31.63 64.0 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.714 0.635 . . . . 61.22 112.714 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.04 -48.72 80.57 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.036 0.446 . . . . 70.54 111.487 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -83.8 -15.08 49.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.324 -0.398 . . . . 73.05 111.387 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 76.3 t60 55.77 68.24 0.89 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.593 0.711 . . . . 64.45 111.114 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.51 HG21 HG23 ' A' ' 43' ' ' THR . 69.5 t -102.41 -60.21 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 115.632 -0.713 . . . . 73.24 112.631 -175.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.403 ' O ' ' NZ ' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -132.22 17.97 4.49 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.066 0.46 . . . . 73.5 111.12 -174.671 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -78.77 158.1 28.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.339 0.59 . . . . 74.2 111.939 -177.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.412 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -89.73 2.3 55.01 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.817 -0.629 . . . . 54.52 112.31 -177.439 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 63.07 84.31 0.15 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 121.076 0.465 . . . . 73.32 111.835 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -176.79 -151.9 9.36 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 120.586 -0.816 . . . . 74.24 113.52 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.7 -120.74 15.28 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.562 -0.351 . . . . 71.42 112.944 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -141.49 55.02 1.52 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.28 0.562 . . . . 74.44 110.086 173.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 148' ' ' GLU . 5.1 p80 -54.98 124.55 17.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.416 -0.811 . . . . 64.23 111.984 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . 0.423 ' C ' ' H ' ' A' ' 163' ' ' HIS . 46.0 p-80 -74.77 -54.42 7.37 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.717 -0.219 . . . . 62.12 111.432 -176.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 53.92 0.56 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.684 0.994 . . . . 70.44 113.684 -179.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.423 ' H ' ' C ' ' A' ' 161' ' ' HIS . 98.8 m-70 -84.49 159.69 20.69 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.665 -0.647 . . . . 73.22 111.261 179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 17.9 m80 . . . . . 0 C--O 1.255 1.383 0 CA-C-O 119.177 -0.44 . . . . 72.14 111.46 -179.714 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.124 0.487 . . . . 64.44 110.931 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -141.67 123.85 15.56 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.912 -0.586 . . . . 72.33 111.031 -177.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -79.3 178.73 7.86 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.999 0.428 . . . . 62.44 111.959 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -63.69 -45.55 89.55 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.492 -0.322 . . . . 70.54 111.839 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 137' ' ' LEU . 65.1 tp -61.02 -39.9 91.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.022 0.439 . . . . 75.41 111.146 -178.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -59.25 -47.91 83.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.202 -0.454 . . . . 75.23 110.951 174.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -44.36 94.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 111.939 0.348 . . . . 72.02 111.939 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -56.57 -52.44 64.8 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.256 0.551 . . . . 73.33 110.736 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.9 m -61.85 -43.78 98.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.775 -0.648 . . . . 75.13 111.261 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.1 -46.71 85.07 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.284 -0.416 . . . . 75.35 111.544 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -58.07 -51.17 70.79 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.935 0.398 . . . . 73.42 111.151 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.5 mt -58.62 -50.67 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.004 0.43 . . . . 74.1 111.672 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.455 HD13 HG23 ' A' ' 125' ' ' ILE . 84.7 mt -65.94 -48.77 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.217 -0.447 . . . . 63.24 111.818 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -55.34 -46.61 76.39 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.891 0.377 . . . . 71.35 110.845 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.599 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 3.3 mtt85 -53.86 -57.07 12.29 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.15 -0.477 . . . . 73.51 111.285 174.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -53.84 -45.33 70.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.394 0.516 . . . . 72.3 112.394 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.23 -45.77 87.1 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.826 0.346 . . . . 75.41 111.292 177.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.7 mmm180 -61.49 -48.34 81.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.894 0.378 . . . . 74.33 111.296 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 18.6 mm-40 -56.15 -51.63 67.29 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.129 0.49 . . . . 74.5 111.803 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.476 ' HA ' HE21 ' A' ' 20' ' ' GLN . 0.1 OUTLIER -70.92 -36.25 72.59 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.161 -0.472 . . . . 73.22 112.094 -176.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.5 72.83 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.043 0.386 . . . . 60.2 112.043 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.5 p -95.2 -17.06 22.06 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.338 0.496 . . . . 74.33 112.338 -178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.95 48.12 12.27 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.228 -0.511 . . . . 60.3 113.236 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -129.88 174.23 9.93 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.345 0.498 . . . . 64.12 112.345 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.517 ' HA ' ' NH1' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -129.64 145.62 51.49 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.068 -0.515 . . . . 64.22 110.761 176.284 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -88.33 152.2 22.09 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.66 0.615 . . . . 74.34 112.66 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.9 t -144.28 -5.8 0.75 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.53 -0.759 . . . . 74.23 112.007 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' A' ' 28' ' ' LYS . 3.3 mppt? -81.14 153.02 71.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-O 120.699 0.285 . . . . 73.51 111.282 -177.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.25 131.53 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.347 2.032 . . . . 63.41 112.34 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 55.5 tpp -60.41 149.23 34.64 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 121.163 0.506 . . . . 65.4 111.818 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.63 4.7 67.73 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.279 0.871 . . . . 42.52 115.279 -173.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -155.64 -76.64 0.1 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.128 0.964 . . . . 74.33 112.003 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -95.01 136.54 35.2 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.453 -0.154 . . . . 72.21 110.864 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.36 -93.27 0.5 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 121.113 -0.565 . . . . 62.45 114.265 -177.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.9 -49.66 72.8 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.635 0.976 . . . . 72.52 113.635 -172.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.5 m -56.33 -46.23 80.02 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.949 0.351 . . . . 75.14 111.949 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.2 p -63.67 -44.43 93.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.892 0.377 . . . . 73.24 111.302 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.8 mtp180 -63.67 -54.04 41.9 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.1 0.408 . . . . 75.42 112.1 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HG3' HG21 ' A' ' 147' ' ' VAL . 0.2 OUTLIER -56.75 -37.93 71.72 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.814 0.34 . . . . 71.44 110.879 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.29 72.98 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.857 0.361 . . . . 73.13 111.445 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 44.2 tp -63.96 -44.93 91.28 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.423 -0.353 . . . . 65.42 111.828 -178.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.25 -34.49 78.12 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 122.181 -0.324 . . . . 74.3 110.677 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.565 ' O ' HG23 ' A' ' 47' ' ' VAL . 89.7 m -61.22 -46.58 89.85 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.738 0.304 . . . . 72.2 110.385 172.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -53.99 -31.64 51.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.441 -0.345 . . . . 72.43 111.673 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.517 ' NH1' ' HA ' ' A' ' 25' ' ' LYS . 65.3 mtt-85 -72.64 -54.88 7.84 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 122.031 -0.418 . . . . 74.11 111.272 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.434 ' NH1' HG11 ' A' ' 152' ' ' VAL . 15.8 ptm180 -63.69 -43.87 95.36 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.502 0.556 . . . . 75.41 112.502 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 43' ' ' THR . 10.7 m -87.23 -33.63 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 122.119 -0.363 . . . . 72.53 111.824 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.42 -48.33 58.22 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 120.831 -0.7 . . . . 72.42 112.808 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.585 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.0 t70 -57.27 -52.28 65.95 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.912 0.387 . . . . 71.31 110.719 176.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.21 -52.1 46.26 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 121.189 -0.529 . . . . 54.22 112.857 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.43 HG22 HG12 ' A' ' 96' ' ' VAL . 63.4 t -58.04 -43.43 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 111.726 0.269 . . . . 73.13 111.726 178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.443 ' HG3' ' HG ' ' A' ' 100' ' ' SER . 44.6 mt-30 -55.73 -45.77 77.91 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.65 0.262 . . . . 60.54 111.52 177.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.585 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 53.2 mtp85 -66.81 -37.73 85.1 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.729 0.64 . . . . 74.02 112.729 -173.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HB3' ' HD2' ' A' ' 163' ' ' HIS . 8.5 p30 -85.87 -22.15 27.67 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.592 -0.693 . . . . 73.25 112.142 177.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.448 ' HD2' ' OD1' ' A' ' 54' ' ' ASN . 12.9 m170 -86.43 -21.87 26.86 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.161 -0.337 . . . . 71.53 111.775 175.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.92 -48.46 60.69 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.414 0.524 . . . . 73.51 112.414 -176.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.7 t -56.3 -28.4 58.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.135 0.493 . . . . 75.41 112.079 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.57 -38.32 23.85 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.948 0.404 . . . . 64.3 111.718 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -76.23 -33.16 59.21 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.624 0.601 . . . . 71.52 112.624 -176.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 63.5 mm-40 -46.29 -56.52 5.67 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.603 0.594 . . . . 73.54 112.603 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.99 -22.65 58.12 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 121.367 -0.444 . . . . 44.42 114.139 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.545 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 26.4 mtm -87.4 -36.54 17.7 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 122.032 -0.687 . . . . 72.24 109.44 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.462 HD21 ' CE2' ' A' ' 104' ' ' PHE . 12.3 tp -60.1 -33.1 71.65 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.522 -0.763 . . . . 62.41 110.953 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 54.3 mtt85 -65.47 -42.78 91.89 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.741 -0.663 . . . . 74.42 112.056 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.545 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -77.1 -15.64 59.49 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.786 0.326 . . . . 75.1 110.781 177.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 62' ' ' MET . 95.8 mt -81.95 -80.82 0.15 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.342 -0.39 . . . . 61.24 111.27 175.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.2 t70 45.24 90.44 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.34 0.656 . . . . 61.23 111.647 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.52 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.8 mp -68.55 102.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.244 0.545 . . . . 55.54 111.619 -175.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -12.03 27.81 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.128 -0.487 . . . . 70.35 111.892 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.0 175.16 11.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.043 0.449 . . . . 63.34 112.02 174.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -50.83 -36.99 40.31 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.881 -0.6 . . . . 72.3 112.494 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.543 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 37.7 t70 -56.87 -39.71 74.85 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 111.879 0.325 . . . . 73.24 111.879 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.506 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.0 m-20 -63.18 -36.07 82.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.883 0.373 . . . . 65.13 110.814 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.13 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.075 0.464 . . . . 65.3 110.511 175.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.543 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 9.6 mtmp? -63.96 -29.94 71.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.009 0.433 . . . . 75.31 110.821 175.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -67.57 -40.47 84.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.016 0.436 . . . . 65.23 110.618 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.1 mt -58.78 -34.73 71.77 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.402 -0.363 . . . . 71.24 111.211 176.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 82' ' ' ILE . 47.0 m -52.16 -37.75 55.52 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.941 0.4 . . . . 65.22 110.945 176.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.467 ' HD3' HD11 ' A' ' 82' ' ' ILE . 31.0 mmt180 -64.07 -48.87 74.54 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.315 -0.402 . . . . 75.31 111.399 175.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 86.8 t -55.29 -40.99 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.116 0.484 . . . . 61.14 110.489 175.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.499 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.2 mmt -60.79 -38.57 85.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.85 -0.614 . . . . 72.2 111.436 177.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.467 HD11 ' HD3' ' A' ' 79' ' ' ARG . 85.5 mt -61.32 -38.36 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-O 121.027 0.442 . . . . 72.55 110.623 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.411 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 63.0 m-70 -68.8 -28.8 67.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.383 -0.371 . . . . 74.31 111.47 175.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 95.1 t -61.37 -34.48 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.919 0.39 . . . . 75.33 111.183 174.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.506 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 22.8 m-85 -96.57 15.95 20.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.012 0.375 . . . . 75.32 112.012 176.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.4 t -69.44 -30.49 68.43 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.127 0.489 . . . . 51.31 110.511 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.68 104.83 2.09 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.871 -0.604 . . . . 71.23 111.012 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.74 67.33 1.99 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 121.331 -0.462 . . . . 74.24 112.896 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 18.8 t -132.28 141.4 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-O 120.856 0.36 . . . . 72.55 111.103 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -77.5 4.95 9.89 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.937 0.717 . . . . 62.43 112.937 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -73.65 116.95 14.84 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.085 0.469 . . . . 75.14 111.689 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.519 ' HE3' HG13 ' A' ' 95' ' ' ILE . 95.9 m95 -60.15 -10.66 4.68 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 112.761 0.652 . . . . 74.14 112.761 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.05 -25.06 53.08 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 121.228 -0.51 . . . . 60.21 112.86 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -70.57 -35.58 73.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.519 -0.401 . . . . 71.51 111.046 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.519 HG13 ' HE3' ' A' ' 92' ' ' TRP . 45.3 mm -62.73 -45.31 99.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.31 0.576 . . . . 72.41 110.037 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.43 HG12 HG22 ' A' ' 51' ' ' VAL . 43.5 t -56.02 -47.4 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 115.657 -0.702 . . . . 63.33 110.75 174.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 94.3 m -55.13 -44.14 74.79 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.537 -0.301 . . . . 74.23 111.517 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.538 ' HG ' HG22 ' A' ' 125' ' ' ILE . 22.2 tp -58.46 -55.67 32.07 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.396 0.617 . . . . 65.31 111.648 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 55.8 mt -71.09 -32.56 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.784 -0.644 . . . . 64.53 111.317 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.443 ' HG ' ' HG3' ' A' ' 52' ' ' GLN . 40.4 t -61.6 -52.05 66.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.892 -0.594 . . . . 74.43 111.244 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.476 ' O ' HG21 ' A' ' 105' ' ' VAL . 23.4 t80 -63.95 -35.99 82.48 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.692 0.282 . . . . 75.21 110.87 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.08 -48.67 84.95 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 120.985 -0.626 . . . . 72.01 112.574 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.46 83.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.859 0.361 . . . . 74.51 111.348 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.462 ' CE2' HD21 ' A' ' 63' ' ' LEU . 78.3 t80 -60.72 -46.65 89.59 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.387 -0.369 . . . . 74.11 111.232 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 101' ' ' PHE . 58.0 t -64.88 -37.33 79.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 120.908 0.385 . . . . 74.12 110.512 175.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.73 -39.22 70.83 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.112 -0.495 . . . . 75.25 111.496 176.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -56.08 -49.27 74.26 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.359 0.6 . . . . 72.32 110.653 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.517 ' O ' HG12 ' A' ' 112' ' ' ILE . 58.3 t60 -63.35 -41.9 98.89 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.725 -0.671 . . . . 73.33 111.016 -179.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.52 HD21 ' HB ' ' A' ' 68' ' ' ILE . 88.5 mt -63.11 -49.96 72.4 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.062 0.458 . . . . 75.51 111.451 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -59.67 -30.26 68.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.667 -0.697 . . . . 75.53 110.63 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.5 m -77.31 -48.75 16.58 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.008 -0.542 . . . . 70.53 112.246 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.517 HG12 ' O ' ' A' ' 108' ' ' HIS . 42.2 pt -83.79 24.32 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 112.681 0.623 . . . . 73.33 112.681 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 62.4 18.09 10.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.549 0.574 . . . . 61.14 112.549 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -102.88 31.41 4.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.24 0.543 . . . . 62.51 110.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.26 -33.58 67.75 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.675 -0.693 . . . . 53.52 112.386 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 62.3 m -56.34 -32.75 64.98 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 120.886 0.374 . . . . 61.4 111.772 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.425 ' HB2' HD12 ' A' ' 109' ' ' LEU . 48.2 m -62.29 -26.76 68.59 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.223 0.453 . . . . 75.34 112.223 -179.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.27 -44.22 74.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.849 0.685 . . . . 53.31 112.849 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -64.04 -53.76 45.66 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 112.52 0.563 . . . . 64.15 112.52 -175.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.34 -28.05 71.77 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.833 1.689 . . . . 73.35 112.276 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.42 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.2 tt -61.86 -40.68 96.22 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.99 0.424 . . . . 74.02 109.994 175.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.76 -33.83 73.53 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.239 -0.437 . . . . 75.13 111.233 175.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.344 -0.389 . . . . 63.12 110.908 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.8 m -59.01 -45.33 90.96 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.956 0.408 . . . . 38.29 111.276 175.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.538 HG22 ' HG ' ' A' ' 98' ' ' LEU . 44.5 mm -57.27 -53.17 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.213 0.53 . . . . 71.1 111.09 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 36.7 m -65.55 -38.52 89.83 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.798 -0.637 . . . . 61.05 111.91 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 29.5 t70 -59.39 -51.83 68.22 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.602 0.239 . . . . 64.44 111.226 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.492 HG23 ' HB2' ' A' ' 81' ' ' MET . 67.8 t -63.9 -39.62 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.928 0.394 . . . . 71.11 111.086 178.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.446 ' HG ' HD13 ' A' ' 137' ' ' LEU . 45.3 tp -55.63 -52.47 63.7 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.324 0.583 . . . . 73.0 110.902 176.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 95.0 t -72.76 -30.44 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.806 -0.633 . . . . 71.31 111.633 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 2.0 tpt180 -57.36 -30.26 64.7 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.116 0.413 . . . . 74.14 112.116 -175.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.609 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.1 OUTLIER -130.18 -30.78 1.93 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.451 0.908 . . . . 72.23 113.451 -176.887 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.609 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.4 mptp? -112.36 23.83 13.2 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.425 -0.797 . . . . 74.22 113.007 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 16.2 ttp180 -53.85 -65.39 0.58 Allowed 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.666 0.746 . . . . 61.05 112.187 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.93 -31.6 71.94 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.154 -0.93 . . . . 62.24 111.097 -173.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -68.6 -35.82 77.87 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.404 -0.362 . . . . 75.54 111.621 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.534 ' HB2' HD22 ' A' ' 5' ' ' LEU . 52.6 mt -54.64 -45.6 73.82 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 120.555 0.217 . . . . 72.24 111.534 175.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.3 p -78.88 -43.78 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 112.329 0.492 . . . . 51.12 112.329 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -60.87 -57.76 11.29 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.128 0.489 . . . . 73.24 112.167 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -87.61 1.41 53.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.5 -0.318 . . . . 71.44 111.514 -177.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 58.15 62.2 2.1 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.306 -0.406 . . . . 72.14 110.507 -178.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . 0.407 ' O ' ' HB2' ' A' ' 146' ' ' PHE . . . -42.85 -52.56 5.58 Favored Glycine 0 C--O 1.223 -0.545 0 CA-C-N 115.689 -0.687 . . . . 74.15 114.319 -174.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -72.04 -21.06 61.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.439 0.533 . . . . 74.0 112.439 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -84.82 -58.22 2.8 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.1 0.476 . . . . 71.34 110.66 174.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.563 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -56.84 -32.04 61.65 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 115.978 -0.555 . . . . 61.3 113.112 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.407 ' HB2' ' O ' ' A' ' 142' ' ' GLY . 80.3 t80 -54.88 -39.26 68.51 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.317 0.58 . . . . 70.12 111.14 174.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.531 HG21 ' HG3' ' A' ' 39' ' ' LYS . 96.2 t -73.51 -43.2 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 115.721 -0.672 . . . . 74.0 112.263 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.563 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 10.0 pt-20 -73.31 -33.75 65.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 111.934 0.346 . . . . 53.12 111.934 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -56.66 -48.2 78.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.1 0.476 . . . . 74.31 111.232 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.49 -5.35 59.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 74.22 111.688 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 60.74 50.44 5.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.546 0.689 . . . . 74.44 111.917 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.451 HG22 ' OG1' ' A' ' 43' ' ' THR . 97.4 t -68.77 -29.13 42.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.468 -0.787 . . . . 74.23 112.171 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.01 7.88 4.72 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.979 0.419 . . . . 73.12 111.186 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -103.0 120.66 41.04 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.154 -0.475 . . . . 74.1 112.183 -171.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -21.98 65.1 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.259 0.552 . . . . 64.32 110.665 172.129 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -81.39 57.34 3.22 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.939 -0.573 . . . . 71.52 111.115 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 149.26 136.26 2.61 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 121.028 -0.605 . . . . 75.52 113.505 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -97.06 -144.74 17.82 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 121.406 -0.426 . . . . 74.12 113.039 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -90.13 115.47 27.4 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.04 0.448 . . . . 72.24 111.718 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.25 -57.34 10.76 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.873 -0.603 . . . . 62.24 111.753 -178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.11 145.18 17.92 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.484 -0.325 . . . . 74.25 110.593 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 14.6 p80 -149.51 -177.89 6.12 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.749 0.309 . . . . 73.31 111.074 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.452 ' HD2' ' HB3' ' A' ' 54' ' ' ASN . 33.3 t-80 -82.94 115.46 21.8 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.591 -0.277 . . . . 65.3 110.865 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.5 p80 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.862 -0.59 . . . . 74.44 111.341 177.836 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ptt? . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 111.961 0.356 . . . . 75.25 111.961 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.97 156.58 20.41 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.161 0.505 . . . . 62.5 112.236 -175.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -54.98 149.78 11.26 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.951 -0.568 . . . . 70.35 111.287 174.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.444 ' HG2' ' NH1' ' A' ' 32' ' ' ARG . 30.1 tt0 -56.71 -46.03 81.49 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.242 0.544 . . . . 74.41 111.496 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 137' ' ' LEU . 59.8 tp -68.96 -33.5 73.8 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.218 -0.447 . . . . 62.45 110.69 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -59.88 -47.19 86.78 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.246 -0.434 . . . . 65.14 109.954 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -57.04 -49.64 75.21 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.965 0.358 . . . . 73.03 111.965 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.602 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 60.6 tt0 -62.53 -48.17 80.72 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.426 0.631 . . . . 63.1 111.475 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 m -59.86 -32.09 70.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.117 0.484 . . . . 54.2 110.751 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -72.75 -46.22 54.55 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.131 -0.486 . . . . 73.34 111.865 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.602 ' HG2' ' O ' ' A' ' 8' ' ' GLN . 14.1 pt-20 -57.59 -43.07 84.33 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.965 0.412 . . . . 63.24 110.765 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 67.1 mt -65.15 -54.7 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 116.053 -0.521 . . . . 72.4 111.895 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.402 HD11 HG23 ' A' ' 125' ' ' ILE . 76.5 mt -66.4 -51.16 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.836 0.35 . . . . 75.31 111.857 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.517 ' HA ' ' HB1' ' A' ' 122' ' ' ALA . 47.7 t -50.04 -51.27 43.55 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.229 -0.441 . . . . 72.42 111.559 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.521 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 28.0 mtp180 -58.75 -45.99 88.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 120.853 -0.339 . . . . 74.1 111.517 176.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -53.43 -44.18 68.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.882 0.327 . . . . 74.02 111.882 -176.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -62.22 -42.65 99.5 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.815 -0.175 . . . . 63.42 111.348 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.561 ' NH2' ' HG2' ' A' ' 119' ' ' GLU . 8.4 mpt_? -61.55 -48.26 81.79 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.689 0.28 . . . . 70.51 111.34 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 16.1 mm-40 -54.45 -46.81 73.36 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.415 0.626 . . . . 74.23 111.062 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.68 ' HG3' ' HE2' ' A' ' 107' ' ' LYS . 8.6 tp-100 -75.64 -43.05 49.75 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.761 -0.654 . . . . 73.33 112.369 -175.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.27 80.38 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.251 0.463 . . . . 61.43 112.251 -177.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.8 p -87.02 -28.62 22.51 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.799 0.333 . . . . 64.55 111.644 -177.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.88 6.27 88.56 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.213 -0.517 . . . . 72.11 112.875 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.79 115.19 23.37 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.9 0.381 . . . . 72.51 111.443 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -74.83 128.76 36.35 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.296 -0.411 . . . . 73.31 111.025 177.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.94 153.34 20.92 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.383 0.611 . . . . 72.43 111.898 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 t -94.32 1.48 55.9 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.005 -0.543 . . . . 73.51 112.253 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 96.8 mttt -51.16 137.99 27.21 Favored Pre-proline 0 N--CA 1.477 0.875 0 N-CA-C 112.213 0.449 . . . . 74.01 112.213 177.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 28' ' ' LYS . 17.5 Cg_exo -66.33 72.76 0.39 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.27 2.647 . . . . 62.51 113.709 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.412 ' HE3' ' HB3' ' A' ' 37' ' ' SER . 92.6 mmm 37.44 -89.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.89 1.07 . . . . 75.0 113.89 175.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -173.0 -50.12 0.05 OUTLIER Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.488 -0.324 . . . . 75.33 112.575 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.444 ' NH1' ' HG2' ' A' ' 4' ' ' GLU . 27.9 ttt180 -137.66 -64.42 0.55 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.092 0.472 . . . . 74.32 111.203 178.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.555 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 42.6 m -83.05 170.96 14.28 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.219 0.533 . . . . 75.11 112.433 -172.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -110.88 -93.21 2.18 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 116.033 -0.531 . . . . 75.11 113.783 -176.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.88 -50.13 61.6 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.862 0.69 . . . . 72.23 112.862 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.512 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 90.5 m -64.3 -40.48 96.02 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.866 0.365 . . . . 75.13 111.635 -177.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.555 ' OG ' ' HB2' ' A' ' 33' ' ' SER . 62.2 m -66.06 -42.19 89.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.712 0.291 . . . . 53.22 111.453 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -68.87 -52.77 26.14 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.627 0.251 . . . . 74.41 111.335 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HB2' HG11 ' A' ' 147' ' ' VAL . 20.6 ptmt -54.97 -39.49 69.03 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.958 0.409 . . . . 62.55 110.556 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.1 -53.2 33.05 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.261 -0.427 . . . . 74.33 111.706 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.539 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.0 tp -59.55 -40.51 87.49 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.521 0.563 . . . . 75.3 112.521 -176.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.405 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 12.3 pt-20 -73.4 -41.39 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.273 -0.267 . . . . 75.24 111.442 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.438 ' O ' HG23 ' A' ' 47' ' ' VAL . 82.7 m -69.26 -34.34 74.63 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 122.097 -0.377 . . . . 65.01 111.275 178.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -56.51 -44.05 80.37 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.883 0.327 . . . . 60.4 111.883 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.539 HH21 ' HG ' ' A' ' 41' ' ' LEU . 19.2 ptp180 -78.61 -32.38 47.47 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.996 0.427 . . . . 65.32 110.962 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.439 HH11 ' HD2' ' A' ' 46' ' ' ARG . 20.8 ttt180 -58.62 -44.88 90.11 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.061 -0.518 . . . . 75.22 111.759 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 43' ' ' THR . 32.8 m -91.66 -33.11 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.014 0.435 . . . . 74.25 111.223 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.46 -32.55 73.25 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 116.167 -0.47 . . . . 61.21 113.759 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.557 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.6 t70 -53.44 -56.65 15.08 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 117.088 0.444 . . . . 74.53 110.875 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.9 -43.79 81.63 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 121.018 -0.61 . . . . 38.63 113.066 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 69.7 t -57.34 -46.06 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 112.039 0.385 . . . . 74.43 112.039 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -63.12 -28.07 69.82 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.878 0.325 . . . . 75.13 111.878 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 46.9 mtt180 -69.29 -52.67 25.17 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 74.41 111.422 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -74.47 -23.06 58.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.824 0.345 . . . . 73.3 111.791 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.408 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 17.1 m170 -82.66 -22.63 34.55 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.593 0.22 . . . . 72.34 111.593 173.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 43.1 tt0 -50.71 -56.6 11.21 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.102 0.408 . . . . 74.03 112.102 -176.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.4 t -54.89 -37.9 66.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.208 0.447 . . . . 72.2 112.208 -178.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.51 -46.04 50.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.893 0.378 . . . . 70.24 111.61 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.408 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.1 m-30 -64.63 -40.22 95.07 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.307 -0.406 . . . . 75.55 111.776 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.603 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 76.4 mm-40 -44.97 -55.07 5.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 120.779 0.323 . . . . 74.15 111.446 177.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.53 -34.76 49.99 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 116.154 -0.476 . . . . 64.33 113.961 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.8 mtm -79.46 -44.18 21.83 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.15 -0.618 . . . . 63.34 111.256 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.84 -32.81 69.75 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 111.665 0.246 . . . . 71.44 111.665 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.603 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 79.5 mtp180 -59.99 -34.87 73.91 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.364 0.602 . . . . 70.44 111.34 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -84.01 -38.88 20.36 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.95 -0.568 . . . . 62.21 111.153 177.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.408 HD12 HD21 ' A' ' 77' ' ' LEU . 83.9 mt -69.56 -76.72 0.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.971 -0.559 . . . . 75.01 111.823 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 t70 43.67 85.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.312 0.577 . . . . 74.32 111.281 -172.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.499 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.7 mp -60.23 106.66 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 115.834 -0.621 . . . . 74.34 111.852 -174.028 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.77 -5.88 20.83 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.183 0.438 . . . . 71.42 112.183 -179.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.508 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -162.92 173.71 13.32 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.808 0.337 . . . . 64.42 111.865 174.912 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.28 -35.99 65.64 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.012 0.434 . . . . 72.21 111.907 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -51.55 -41.7 61.28 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.186 -0.461 . . . . 65.33 112.004 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.499 ' HB2' HG21 ' A' ' 68' ' ' ILE . 42.6 m-20 -60.47 -41.19 93.67 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.686 0.279 . . . . 74.33 111.285 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.24 -42.75 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.276 0.56 . . . . 70.21 110.936 178.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.02 -28.58 65.6 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.132 -0.485 . . . . 75.34 111.195 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -68.45 -37.31 80.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.168 0.508 . . . . 73.12 110.252 171.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 81' ' ' MET . 95.5 mt -60.43 -38.89 85.52 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.172 -0.467 . . . . 53.33 110.771 174.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.429 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.8 t -52.68 -37.92 59.67 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.121 0.486 . . . . 75.23 111.137 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -65.58 -40.33 92.6 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.514 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.93 -40.41 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.946 0.403 . . . . 72.03 110.896 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.471 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.5 mmt -57.17 -36.59 70.96 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.213 0.53 . . . . 72.42 110.759 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -62.08 -40.69 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 115.988 -0.551 . . . . 73.44 110.931 172.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -65.0 -32.6 74.41 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.007 0.373 . . . . 73.43 112.007 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.6 t -54.62 -41.21 54.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.027 0.441 . . . . 64.03 111.609 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.474 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 50.8 m-85 -85.37 -5.38 59.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.016 0.376 . . . . 75.15 112.016 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.6 t -83.59 -8.36 59.33 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.887 0.375 . . . . 73.24 111.292 178.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -50.85 -31.86 18.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.159 0.584 . . . . 73.21 112.181 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.07 -74.0 0.29 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 121.181 -0.533 . . . . 72.41 112.797 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 18.1 m -74.54 68.85 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.592 0.711 . . . . 74.23 111.497 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.601 ' HA ' ' HG3' ' A' ' 94' ' ' ARG . 57.2 m -68.61 84.15 0.28 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.313 0.578 . . . . 73.03 111.729 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -109.3 -177.02 3.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 55.55 110.907 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -63.24 -25.58 68.39 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.993 0.425 . . . . 73.42 111.166 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.75 -29.07 71.15 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 121.04 -0.6 . . . . 38.63 112.832 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.723 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.3 mmp_? -73.07 -32.38 64.98 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.495 -0.414 . . . . 74.51 111.001 176.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.7 mm -58.82 -44.73 91.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.239 0.543 . . . . 71.14 109.933 173.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 t -58.65 -43.83 88.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.814 -0.63 . . . . 70.15 110.762 174.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.4 m -54.79 -50.43 68.54 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.034 0.445 . . . . 72.3 111.218 177.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.503 ' HG ' HG22 ' A' ' 125' ' ' ILE . 34.9 tp -60.38 -54.83 40.89 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.833 -0.622 . . . . 72.41 112.111 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.83 -41.03 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.011 0.374 . . . . 71.41 112.011 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.1 p -59.75 -42.42 93.18 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.627 0.251 . . . . 75.34 111.336 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 105' ' ' VAL . 21.7 t80 -63.05 -44.01 97.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.613 0.244 . . . . 72.22 110.932 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -45.93 93.4 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.051 -0.595 . . . . 70.25 112.917 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.91 78.71 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.035 0.445 . . . . 61.25 111.689 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -62.02 -43.43 98.86 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.024 0.44 . . . . 71.42 110.894 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 91.2 t -65.11 -38.33 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.405 -0.361 . . . . 62.51 110.678 176.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.99 -43.12 66.21 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.794 0.33 . . . . 64.21 111.609 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.68 ' HE2' ' HG3' ' A' ' 20' ' ' GLN . 61.9 mttm -56.61 -49.22 75.57 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.209 0.528 . . . . 71.14 111.295 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.499 ' O ' HG12 ' A' ' 112' ' ' ILE . 77.1 t60 -62.66 -35.38 79.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.145 -0.48 . . . . 73.14 110.938 179.297 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.475 HD11 ' HB2' ' A' ' 117' ' ' SER . 96.1 mt -62.73 -49.52 74.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.34 -0.391 . . . . 74.23 110.977 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.46 ' HA ' ' HG3' ' A' ' 115' ' ' GLU . 85.8 tttt -57.99 -41.53 83.2 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.312 -0.403 . . . . 72.01 111.569 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 96.4 m -59.86 -41.58 91.8 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.13 -0.486 . . . . 63.3 111.849 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.5 pt -94.53 23.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.099 0.407 . . . . 74.44 112.099 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 70.37 1.36 3.57 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.096 0.776 . . . . 71.2 113.096 174.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 68' ' ' ILE . 15.1 mm100 -86.22 35.62 0.65 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 112.549 0.574 . . . . 71.35 112.549 -175.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.46 ' HG3' ' HA ' ' A' ' 110' ' ' LYS . 37.6 mt-10 -56.65 -31.76 64.7 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.671 0.272 . . . . 62.0 111.71 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 m -55.06 -32.35 61.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.002 0.43 . . . . 73.44 111.319 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . 0.475 ' HB2' HD11 ' A' ' 109' ' ' LEU . 50.1 m -70.17 -27.72 64.75 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.138 -0.483 . . . . 70.51 112.157 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.4 mt -54.51 -41.11 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.254 0.465 . . . . 64.54 112.254 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.561 ' HG2' ' NH2' ' A' ' 18' ' ' ARG . 30.8 mt-10 -65.57 -55.91 21.56 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 112.724 0.639 . . . . 73.32 112.724 -174.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.84 -28.15 51.1 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 121.78 1.653 . . . . 63.41 112.355 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.432 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.2 tt -64.29 -45.26 88.75 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 109.87 -0.419 . . . . 71.51 109.87 175.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.517 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -57.06 -37.61 72.06 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.969 0.414 . . . . 74.13 111.196 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.51 -36.52 73.81 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.179 -0.464 . . . . 73.22 111.718 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 80.0 p -62.58 -41.2 98.8 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 75.23 111.318 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.503 HG22 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.02 -52.91 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 63.4 110.975 177.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.9 m -69.55 -33.61 73.01 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.843 -0.617 . . . . 75.01 111.523 178.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.57 -52.91 63.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.684 0.278 . . . . 75.14 111.371 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.41 HG22 ' HB2' ' A' ' 81' ' ' MET . 59.6 t -65.43 -41.16 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.11 0.481 . . . . 61.31 110.818 178.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.547 ' HG ' HD13 ' A' ' 137' ' ' LEU . 51.9 tp -54.81 -52.39 62.84 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.847 -0.615 . . . . 74.13 111.427 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.421 HG13 ' HD3' ' A' ' 134' ' ' ARG . 92.7 t -75.57 -26.94 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.142 -0.481 . . . . 75.21 111.708 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -60.53 -26.51 66.93 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.021 0.378 . . . . 73.23 112.021 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.564 HG21 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -131.44 -40.82 1.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.051 1.13 . . . . 71.41 114.051 -179.316 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.564 ' HD2' HG21 ' A' ' 132' ' ' THR . 3.3 mptp? -103.25 20.64 17.34 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.692 0.997 . . . . 74.54 113.692 -174.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.512 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.9 ttp180 -56.05 -51.27 68.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.293 0.497 . . . . 74.31 111.607 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -57.39 -45.78 84.14 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.298 -0.41 . . . . 73.44 111.31 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -62.99 -38.33 90.74 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.411 -0.359 . . . . 64.33 111.586 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.547 HD13 ' HG ' ' A' ' 129' ' ' LEU . 65.1 mt -56.15 -49.74 73.09 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.916 0.339 . . . . 70.01 111.916 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.2 p -78.09 -42.25 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 112.166 0.432 . . . . 74.44 112.166 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -67.59 -62.47 1.4 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.169 0.433 . . . . 74.42 112.169 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.5 -8.69 59.31 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.809 0.338 . . . . 70.42 111.441 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 137' ' ' LEU . 46.2 mtt-85 60.62 83.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.551 0.691 . . . . 75.03 111.245 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -66.61 -52.92 31.03 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 115.291 -0.868 . . . . 64.22 114.125 -174.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -68.0 -39.73 83.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.007 0.432 . . . . 73.14 111.437 -175.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -70.6 -52.8 19.03 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.788 0.327 . . . . 70.1 110.901 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -57.3 -38.87 88.88 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 116.182 -0.463 . . . . 63.34 113.446 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.57 -56.32 23.72 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.254 0.55 . . . . 73.22 111.59 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.531 HG11 ' HB2' ' A' ' 39' ' ' LYS . 90.1 t -59.93 -45.21 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.285 0.564 . . . . 72.34 112.053 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.64 ' HG2' ' HA ' ' A' ' 154' ' ' ASP . 40.1 mt-10 -73.68 -24.88 60.02 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.958 -0.565 . . . . 73.14 111.883 -178.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . 0.551 ' HA ' ' O ' ' A' ' 161' ' ' HIS . 78.3 t80 -58.05 -49.1 78.04 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.051 0.453 . . . . 71.11 110.835 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -82.52 -3.79 56.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.995 0.368 . . . . 75.44 111.995 178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 24.1 t60 60.41 81.47 0.18 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.16 0.505 . . . . 72.41 111.702 179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 61.7 t -129.59 -67.39 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 121.21 0.528 . . . . 71.43 110.545 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -119.75 69.42 0.84 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.699 -0.682 . . . . 64.11 110.245 174.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.64 ' HA ' ' HG2' ' A' ' 148' ' ' GLU . 3.1 p30 -99.13 140.67 32.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.753 -0.658 . . . . 64.24 112.574 -175.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.484 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -109.93 -2.1 17.35 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.443 0.64 . . . . 72.43 109.719 172.041 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.474 ' HA ' ' HB3' ' A' ' 160' ' ' HIS . 43.3 mt-10 80.2 -60.85 0.29 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 114.559 -1.2 . . . . 72.31 111.968 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 39.0 29.56 0.09 OUTLIER Glycine 0 CA--C 1.533 1.163 0 O-C-N 123.648 0.592 . . . . 53.2 114.308 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 71.73 -41.78 0.7 Allowed Glycine 0 CA--C 1.535 1.338 0 O-C-N 122.479 -0.424 . . . . 62.25 114.017 -174.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -92.38 4.29 53.7 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.737 1.014 . . . . 74.31 113.737 -169.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . 0.474 ' HB3' ' HA ' ' A' ' 156' ' ' GLU . 28.7 p-80 -55.46 106.5 0.25 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.423 0.63 . . . . 73.41 110.449 175.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . 0.551 ' O ' ' HA ' ' A' ' 149' ' ' PHE . 38.6 m80 -72.38 86.03 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.828 0.677 . . . . 75.41 112.828 -169.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -84.6 -8.53 58.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.658 0.742 . . . . 74.15 109.352 169.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -146.18 150.09 35.19 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.118 -0.946 . . . . 72.31 110.206 172.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 26.5 t60 . . . . . 0 C--O 1.254 1.307 0 CA-C-O 118.551 -0.737 . . . . 74.15 111.596 -179.701 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.398 0.618 . . . . 75.14 110.764 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.19 178.19 8.96 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.646 -0.706 . . . . 60.45 111.433 -175.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.11 158.64 16.53 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.969 -0.56 . . . . 65.23 111.547 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -55.46 -37.27 67.54 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.394 0.616 . . . . 75.14 109.928 172.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.87 -41.47 74.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.545 -0.752 . . . . 65.25 111.554 174.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -67.41 -39.97 85.56 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.93 0.395 . . . . 74.42 110.565 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -67.18 -42.74 83.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.333 -0.394 . . . . 74.41 111.539 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.463 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.1 tt0 -61.61 -52.25 65.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.836 0.351 . . . . 64.14 111.222 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 p -58.86 -52.4 65.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.156 -0.475 . . . . 61.1 111.253 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.484 HD12 ' HG2' ' A' ' 123' ' ' GLU . 46.1 tp -54.55 -44.4 72.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.17 -0.468 . . . . 74.3 111.54 176.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.402 ' HG2' ' N ' ' A' ' 31' ' ' GLY . 5.3 tp10 -58.02 -51.03 71.37 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.114 0.483 . . . . 72.42 111.402 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 8' ' ' GLN . 75.0 mt -59.59 -52.41 61.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.182 -0.463 . . . . 75.4 111.34 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.415 ' O ' HD11 ' A' ' 17' ' ' LEU . 71.5 mt -62.62 -43.52 98.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 116.133 -0.485 . . . . 73.14 111.751 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 29.3 t -56.04 -54.87 39.73 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.966 0.412 . . . . 75.4 111.929 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.451 ' HD2' ' SD ' ' A' ' 30' ' ' MET . 85.5 mtt-85 -68.3 -34.35 75.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.543 -0.299 . . . . 61.41 111.326 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -59.71 -50.92 71.95 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.904 0.383 . . . . 73.24 111.332 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.489 HD22 ' HB3' ' A' ' 122' ' ' ALA . 10.8 mp -60.64 -37.94 83.14 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 122.288 -0.258 . . . . 75.53 111.488 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 14' ' ' SER . 49.8 mmm-85 -65.71 -56.71 10.64 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 111.875 0.324 . . . . 75.35 111.875 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 10.5 pt-20 -57.17 -39.13 74.71 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.989 0.424 . . . . 70.14 112.085 -178.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -68.03 -37.27 81.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.827 0.346 . . . . 75.33 111.303 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.23 -36.07 61.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.37 0.508 . . . . 70.43 112.37 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 71.9 p -85.8 -37.0 19.74 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.798 0.333 . . . . 65.21 111.669 -175.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.71 60.94 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.098 -0.572 . . . . 74.34 112.487 -177.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -146.76 144.5 29.43 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.856 0.36 . . . . 72.22 111.162 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HD3' ' NH2' ' A' ' 45' ' ' ARG . 17.9 mmmt -72.82 151.94 41.78 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.622 0.725 . . . . 64.35 112.732 -178.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.9 175.08 5.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.758 -1.11 . . . . 72.53 111.659 -179.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.0 t -102.05 5.33 40.5 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.525 0.679 . . . . 71.3 110.5 172.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -109.24 143.45 27.73 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 115.709 -0.678 . . . . 65.03 112.18 -170.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.03 179.84 5.88 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.059 2.506 . . . . 63.53 113.137 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.628 ' SD ' HD22 ' A' ' 41' ' ' LEU . 88.1 mmm -92.47 -170.1 2.4 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.396 0.517 . . . . 73.13 112.396 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.402 ' N ' ' HG2' ' A' ' 11' ' ' GLU . . . -69.68 -176.22 15.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 116.102 -0.499 . . . . 52.5 114.192 -177.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 32' ' ' ARG . 57.2 mtt180 -63.87 -15.04 58.0 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.821 0.674 . . . . 61.11 112.821 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.1 m -82.38 -1.65 50.56 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.84 0.311 . . . . 73.15 111.84 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 47.96 -102.08 0.05 OUTLIER Glycine 0 CA--C 1.529 0.908 0 N-CA-C 114.659 0.623 . . . . 61.41 114.659 172.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.23 -49.73 73.32 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.535 0.569 . . . . 53.21 112.535 -175.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.433 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 89.1 m -57.25 -46.34 83.12 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.931 0.396 . . . . 71.14 111.422 -179.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.406 ' HA ' HD13 ' A' ' 12' ' ' ILE . 22.7 p -70.47 -30.98 67.94 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.532 -0.304 . . . . 74.1 111.779 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -70.76 -56.14 7.04 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.656 0.243 . . . . 70.32 111.656 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.561 ' HG3' HG21 ' A' ' 147' ' ' VAL . 51.2 pttt -60.08 -37.26 79.37 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.739 0.304 . . . . 74.41 111.181 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.65 -46.76 89.08 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.714 0.292 . . . . 50.54 111.152 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.628 HD22 ' SD ' ' A' ' 30' ' ' MET . 52.4 tp -56.82 -54.1 50.24 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.993 0.425 . . . . 73.24 112.039 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 11.9 pt-20 -71.34 -26.4 62.81 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.332 0.493 . . . . 72.41 112.332 -176.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.439 ' O ' HG23 ' A' ' 47' ' ' VAL . 96.3 m -72.35 -36.47 68.81 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.976 -0.452 . . . . 73.02 110.734 173.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.1 mt -54.25 -49.92 68.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.049 0.389 . . . . 73.45 112.049 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.486 ' NH2' ' HD3' ' A' ' 25' ' ' LYS . 5.6 ptp180 -62.35 -42.36 99.33 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.424 0.527 . . . . 72.5 112.424 -176.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -72.69 -33.07 66.26 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.364 0.505 . . . . 73.31 112.364 -174.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 43' ' ' THR . 19.3 m -93.99 -29.64 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.911 0.386 . . . . 70.31 111.721 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.404 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -77.04 -50.57 6.75 Favored Glycine 0 CA--C 1.522 0.497 0 CA-C-N 116.229 -0.442 . . . . 72.45 113.936 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -53.02 -45.78 68.13 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 117.11 0.455 . . . . 61.04 111.406 -176.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.58 -47.44 90.03 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.105 -0.569 . . . . 75.12 112.839 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 75.9 t -57.77 -45.05 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.86 0.362 . . . . 64.21 110.905 176.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 26.8 mt-30 -56.32 -41.62 76.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.156 176.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -67.42 -47.7 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.382 0.512 . . . . 61.02 112.382 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -70.82 -32.83 70.02 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.283 0.563 . . . . 71.32 111.425 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -81.42 -18.37 45.64 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.247 -0.433 . . . . 75.23 112.077 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -48.84 -43.56 38.71 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.578 0.585 . . . . 75.43 112.578 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.0 t -55.2 -34.67 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.928 0.394 . . . . 74.43 111.608 178.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.77 -41.37 21.27 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.368 -0.378 . . . . 63.21 111.799 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -64.7 -40.87 96.12 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.96 0.356 . . . . 72.22 111.96 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -54.37 -36.31 63.75 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.8 0.333 . . . . 71.23 111.344 178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.57 -31.7 63.87 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 116.188 -0.46 . . . . 74.53 112.834 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 59.1 mtm -89.27 -43.82 10.69 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.72 0.295 . . . . 54.12 111.019 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mp -53.07 -34.24 55.66 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.236 0.458 . . . . 73.44 112.236 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -66.09 -28.99 69.24 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.105 0.409 . . . . 74.14 112.105 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -9.24 23.15 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.121 0.486 . . . . 73.33 111.273 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -89.58 -74.87 0.46 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.31 -0.405 . . . . 75.31 111.155 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 t70 34.29 91.03 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.951 0.9 . . . . 72.35 112.249 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.48 HD12 ' N ' ' A' ' 68' ' ' ILE . 1.7 mp -64.3 104.21 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.87 -0.605 . . . . 72.33 111.888 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.73 -6.15 27.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.138 -0.483 . . . . 71.24 111.697 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.422 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.13 164.72 30.43 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.766 0.317 . . . . 64.04 111.324 173.67 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.95 -30.66 64.25 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.381 0.512 . . . . 62.23 112.381 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.65 -36.7 64.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.095 0.405 . . . . 74.41 112.095 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -62.69 -43.15 99.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.03 0.443 . . . . 71.4 110.409 176.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.3 t -58.25 -48.22 85.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 116.029 -0.532 . . . . 54.33 111.014 177.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -59.83 -33.22 71.48 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.068 0.461 . . . . 74.34 111.095 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.1 t -70.12 -34.25 72.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.387 -0.37 . . . . 61.15 111.375 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.8 mt -58.35 -32.74 68.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.679 0.276 . . . . 72.22 111.111 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.2 t -52.76 -35.48 56.45 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.014 0.435 . . . . 65.12 111.167 176.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -63.63 -46.46 85.61 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.992 0.425 . . . . 74.44 110.57 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.442 ' O ' HG22 ' A' ' 84' ' ' VAL . 60.1 t -58.22 -43.07 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.396 -0.366 . . . . 75.21 110.629 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.3 mmt -56.58 -38.79 72.48 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.855 -0.611 . . . . 72.52 111.84 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 78' ' ' SER . 55.2 mt -65.1 -36.49 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.169 0.509 . . . . 63.24 110.95 175.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.85 -27.76 60.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.246 -0.434 . . . . 72.34 112.103 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 80' ' ' VAL . 70.8 t -52.2 -34.85 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 CA-C-O 120.859 0.362 . . . . 74.01 111.304 177.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.471 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 60.6 m-85 -81.38 29.6 0.36 Allowed 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 112.408 0.521 . . . . 74.34 112.408 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.2 t -84.91 4.14 34.86 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.98 -0.45 . . . . 74.04 111.958 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -55.6 -62.09 1.92 Allowed 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.166 0.508 . . . . 73.01 112.343 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 109.67 -38.49 3.29 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 115.911 -0.586 . . . . 41.42 112.183 -172.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 9.1 p -83.82 132.15 32.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 CA-C-O 121.321 0.582 . . . . 72.44 111.6 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 75.1 p -91.68 52.69 2.08 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.55 0.574 . . . . 75.44 112.55 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.413 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 0.9 OUTLIER -97.83 143.18 28.71 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 122.186 -0.321 . . . . 74.14 110.926 174.672 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -57.03 -21.29 29.96 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.608 0.596 . . . . 75.1 112.608 -177.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.55 52.98 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 121.185 -0.531 . . . . 70.14 113.309 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.413 ' HG2' ' O ' ' A' ' 91' ' ' ASN . 6.9 ptm180 -70.24 -30.63 67.74 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.97 0.414 . . . . 63.15 111.264 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.36 -39.23 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 121.275 0.56 . . . . 61.35 109.622 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.02 -47.7 89.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.593 -0.731 . . . . 72.04 110.775 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.1 m -53.4 -45.81 69.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 111.873 0.323 . . . . 74.22 111.873 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.471 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 40.3 tp -61.23 -55.1 35.91 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.162 0.505 . . . . 71.03 111.909 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.0 mt -68.73 -38.82 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.262 -0.426 . . . . 63.43 111.75 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.9 p -65.1 -45.41 85.32 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.285 -0.416 . . . . 72.34 111.048 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.41 ' O ' HG22 ' A' ' 105' ' ' VAL . 25.1 t80 -56.74 -40.57 75.99 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.762 0.315 . . . . 74.45 110.781 174.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -48.34 84.71 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.037 -0.601 . . . . 62.33 112.457 174.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.453 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.74 -32.35 73.85 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.886 0.374 . . . . 71.2 111.584 177.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -64.73 -46.85 80.51 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.974 0.416 . . . . 74.42 110.688 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.45 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 61.1 t -65.74 -36.77 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 116.347 -0.388 . . . . 63.33 110.227 175.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.91 -46.94 78.28 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.126 -0.488 . . . . 61.44 111.847 177.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -54.78 -47.6 73.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.416 0.627 . . . . 74.2 110.601 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.485 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.9 t60 -63.17 -36.71 84.52 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.714 -0.675 . . . . 74.4 111.31 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 73.9 mt -63.61 -51.07 66.87 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 111.634 0.235 . . . . 74.12 111.634 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -61.25 -38.61 87.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.151 0.501 . . . . 64.44 110.507 179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 93.7 m -57.84 -45.94 85.5 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.853 -0.612 . . . . 72.01 111.397 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.4 pt -88.22 22.09 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 120.752 0.31 . . . . 74.34 111.789 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.615 ' N ' HD21 ' A' ' 113' ' ' ASN . 0.7 OUTLIER 69.34 14.14 8.49 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.885 0.698 . . . . 64.43 112.885 173.106 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -100.78 37.24 1.76 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.167 0.432 . . . . 75.44 112.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.504 ' HG3' HD12 ' A' ' 118' ' ' ILE . 43.3 tt0 -60.2 -34.27 73.4 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.928 -0.482 . . . . 74.54 111.86 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.2 m -57.02 -28.93 62.92 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 122.177 -0.327 . . . . 65.32 111.843 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.7 m -73.48 -26.81 61.07 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.078 0.399 . . . . 63.44 112.078 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.504 HD12 ' HG3' ' A' ' 115' ' ' GLU . 66.2 mt -55.2 -45.92 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.772 0.656 . . . . 44.25 112.772 -177.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.81 -52.38 42.3 Favored Pre-proline 0 CA--C 1.549 0.925 0 N-CA-C 112.693 0.627 . . . . 54.52 112.693 -174.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -59.04 -27.87 86.24 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.568 1.512 . . . . 72.43 112.354 173.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.403 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.8 tt -64.73 -44.95 88.49 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.837 -0.431 . . . . 72.25 109.837 173.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.489 ' HB3' HD22 ' A' ' 17' ' ' LEU . . . -58.26 -40.54 82.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.057 0.456 . . . . 72.01 111.099 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.484 ' HG2' HD12 ' A' ' 10' ' ' LEU . 32.3 mt-10 -63.09 -36.63 84.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.088 -0.506 . . . . 74.22 111.119 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.2 m -65.27 -44.24 88.69 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.595 -0.275 . . . . 72.32 111.287 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 121' ' ' LEU . 48.7 mm -53.98 -53.13 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.131 0.491 . . . . 63.13 110.61 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -62.93 -39.84 95.81 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.669 -0.696 . . . . 74.21 111.625 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -54.35 -51.61 64.22 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.419 -0.355 . . . . 64.14 111.173 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.442 ' O ' HG21 ' A' ' 132' ' ' THR . 58.8 t -68.36 -46.27 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.296 -0.411 . . . . 60.11 111.13 177.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.554 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -51.56 -52.8 44.27 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.848 -0.615 . . . . 72.34 111.89 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.484 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 66.0 t -76.06 -32.19 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 116.194 -0.457 . . . . 74.2 111.861 -178.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -56.19 -39.38 72.34 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.042 0.386 . . . . 73.31 112.042 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.442 HG21 ' O ' ' A' ' 128' ' ' VAL . 2.5 t -104.57 -42.64 5.37 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.886 0.699 . . . . 63.3 112.886 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -102.47 26.12 8.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.681 0.623 . . . . 54.41 112.681 -176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 1.1 tpm_? -45.28 -53.08 8.86 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.088 0.555 . . . . 74.31 112.256 175.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.509 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 3.9 m-20 -69.6 -52.19 28.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 73.34 111.779 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -58.85 -37.94 77.61 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.06 0.392 . . . . 73.44 112.06 -176.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.554 HD11 ' HG ' ' A' ' 129' ' ' LEU . 34.1 mt -54.79 -51.51 65.55 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.037 0.384 . . . . 75.4 112.037 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . 0.415 ' HB ' HH21 ' A' ' 134' ' ' ARG . 14.8 p -79.0 -36.56 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 112.441 0.534 . . . . 72.52 112.441 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 73.9 mmtt -65.52 -45.71 82.44 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.286 0.476 . . . . 64.43 112.286 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -102.32 7.05 40.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.619 0.247 . . . . 74.53 111.561 -176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 52.81 71.79 0.46 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.27 -0.423 . . . . 64.44 110.802 -176.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -49.62 -44.91 38.42 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 114.638 0.615 . . . . 74.12 114.638 -172.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -75.29 -20.02 59.35 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.447 0.536 . . . . 64.41 112.447 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -84.28 -51.06 7.29 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.897 0.379 . . . . 75.45 110.327 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -54.3 -40.31 67.69 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.961 -0.563 . . . . 38.23 113.153 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.35 -53.46 57.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 122.704 0.402 . . . . 71.43 111.894 175.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.561 HG21 ' HG3' ' A' ' 39' ' ' LYS . 80.0 t -64.22 -42.73 96.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.002 0.43 . . . . 53.25 111.988 -177.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.468 ' HB2' ' CB ' ' A' ' 154' ' ' ASP . 12.8 pt-20 -73.91 -27.81 61.23 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.911 0.337 . . . . 60.44 111.911 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -56.15 -46.35 79.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.194 0.521 . . . . 73.23 111.464 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -82.48 4.0 26.07 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.132 -0.485 . . . . 71.22 111.553 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.8 m170 56.52 54.44 7.47 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.806 0.669 . . . . 74.21 112.806 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 56.0 t -83.98 -33.47 9.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.255 0.55 . . . . 71.35 109.873 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -117.0 -64.06 1.36 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.763 -0.653 . . . . 70.1 111.538 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.468 ' CB ' ' HB2' ' A' ' 148' ' ' GLU . 18.0 t70 -57.6 151.53 16.88 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.277 0.56 . . . . 74.25 112.491 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.551 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -126.92 23.92 6.53 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.03 -0.532 . . . . 73.3 112.315 -176.48 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -134.08 -67.19 0.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.161 0.505 . . . . 75.53 111.657 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -77.65 87.61 1.04 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 114.499 0.56 . . . . 74.05 114.499 -172.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -138.89 25.97 2.77 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.708 -0.557 . . . . 75.14 111.708 174.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -69.59 91.54 0.6 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.357 0.663 . . . . 75.31 112.179 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -154.13 129.88 10.07 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.402 . . . . 74.03 111.793 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -120.37 165.61 14.66 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.17 0.51 . . . . 74.31 111.513 175.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -116.12 99.08 6.99 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.098 -0.501 . . . . 73.42 111.064 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -77.52 144.55 37.57 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.13 0.49 . . . . 74.55 111.53 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 41.8 t60 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.781 -0.628 . . . . 64.21 110.83 173.598 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 tpt . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.998 0.428 . . . . 73.51 111.062 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -112.87 177.15 4.73 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.065 -0.516 . . . . 75.53 111.761 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -91.95 162.93 14.19 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 116.374 -0.375 . . . . 72.15 111.446 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.18 -47.83 80.24 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.254 0.549 . . . . 71.52 111.472 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -68.05 -36.54 80.05 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.804 -0.635 . . . . 64.3 110.704 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.39 -51.55 65.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.842 -0.617 . . . . 73.53 110.523 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.4 tpt180 -65.47 -40.78 93.58 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.726 0.269 . . . . 64.31 111.726 -174.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -57.62 -52.94 63.37 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.996 0.427 . . . . 72.32 110.968 174.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.06 -40.57 94.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.001 -0.545 . . . . 71.22 110.755 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.484 HD11 ' HA ' ' A' ' 123' ' ' GLU . 42.1 tp -59.48 -44.83 92.96 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.958 -0.565 . . . . 53.24 111.518 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.499 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 42.7 tt0 -64.91 -50.34 66.89 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.748 0.309 . . . . 71.22 110.982 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.5 -48.03 80.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.884 0.373 . . . . 74.02 111.374 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.457 ' O ' HD13 ' A' ' 17' ' ' LEU . 81.0 mt -64.8 -44.67 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 116.492 -0.322 . . . . 64.4 111.43 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 38.5 t -53.96 -50.96 65.33 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.954 0.407 . . . . 74.15 111.109 177.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 61.7 mtt-85 -61.26 -49.19 78.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.225 -0.443 . . . . 74.34 111.105 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -53.95 -50.85 65.57 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.069 0.396 . . . . 64.23 112.069 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -55.77 -46.82 77.83 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.947 0.404 . . . . 74.22 111.352 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 14' ' ' SER . 35.2 mtp180 -66.02 -53.57 36.86 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 73.33 112.07 -179.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.516 ' CD ' HH21 ' A' ' 45' ' ' ARG . 15.1 pt-20 -62.59 -31.04 71.79 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 111.883 0.327 . . . . 72.34 111.883 -179.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.576 ' HG2' HE22 ' A' ' 52' ' ' GLN . 0.1 OUTLIER -75.57 -27.92 58.77 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.936 0.398 . . . . 71.03 111.241 179.385 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.69 -40.7 17.06 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.945 0.402 . . . . 74.34 111.708 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.2 p -87.39 -37.19 17.28 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.003 0.43 . . . . 73.31 111.955 -177.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.53 10.48 55.56 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.263 -0.494 . . . . 36.7 112.767 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -142.19 126.0 17.08 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 122.546 -0.384 . . . . 54.22 111.957 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 170.46 6.79 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.15 0.5 . . . . 64.54 111.759 177.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -80.38 153.7 28.16 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.189 0.519 . . . . 62.41 111.826 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.4 t -94.76 31.68 1.77 Allowed 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.868 0.842 . . . . 64.1 110.225 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -111.88 158.19 37.42 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.511 -0.768 . . . . 73.42 111.671 -175.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.69 155.82 46.25 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.534 2.156 . . . . 73.4 112.671 173.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.5 mmm -84.8 -177.47 6.59 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.186 0.517 . . . . 74.42 112.159 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -68.1 179.15 19.82 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.515 0.566 . . . . 72.42 114.515 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.69 -24.76 2.44 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.222 1.193 . . . . 74.12 114.222 -173.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 m -83.23 -29.63 28.34 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 122.059 -0.401 . . . . 75.01 112.065 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.9 -100.37 1.46 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 120.841 -0.695 . . . . 73.5 112.443 -174.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -50.63 69.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.136 0.421 . . . . 71.45 112.136 -176.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.06 -33.62 72.31 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.008 0.432 . . . . 73.52 111.176 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.9 t -68.89 -40.99 78.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.38 -0.373 . . . . 75.34 111.15 178.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -62.61 -50.32 71.72 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.42 0.629 . . . . 63.0 110.539 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.416 ' HE3' ' HB2' ' A' ' 153' ' ' GLU . 55.2 mtpt -57.78 -45.4 86.04 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.165 -0.925 . . . . 71.41 111.829 -178.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.406 ' HB1' ' HB3' ' A' ' 143' ' ' TRP . . . -59.4 -49.94 75.89 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.932 0.396 . . . . 62.43 111.383 177.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.9 tp -60.52 -52.6 64.52 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.268 -0.424 . . . . 74.12 111.862 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -61.02 -32.95 72.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.784 0.326 . . . . 50.11 111.589 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.487 ' O ' HG23 ' A' ' 47' ' ' VAL . 83.4 m -73.57 -41.4 62.97 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.269 -0.27 . . . . 72.33 110.836 177.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.8 mt -54.34 -45.64 72.73 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.142 0.423 . . . . 74.33 112.142 178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.516 HH21 ' CD ' ' A' ' 19' ' ' GLU . 12.5 ptp180 -65.02 -42.26 94.56 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.169 -0.332 . . . . 74.11 111.705 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 13.8 ttm180 -68.43 -45.29 72.98 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.921 0.341 . . . . 75.54 111.921 -176.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 43' ' ' THR . 21.0 m -86.32 -31.01 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.908 0.385 . . . . 73.12 111.709 -179.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.98 94.1 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.321 -0.466 . . . . 70.3 112.944 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.49 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 17.9 t70 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.881 0.372 . . . . 72.43 110.823 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.4 -46.42 80.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 121.307 -0.473 . . . . 52.52 112.966 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.66 -42.32 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 120.871 0.367 . . . . 63.21 111.168 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.576 HE22 ' HG2' ' A' ' 20' ' ' GLN . 79.0 mt-30 -63.25 -43.01 99.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.27 -0.423 . . . . 71.22 111.924 179.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 45.3 mtm-85 -58.2 -45.35 87.77 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.014 0.435 . . . . 70.01 111.611 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -73.87 -45.33 51.62 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.212 0.529 . . . . 72.35 111.656 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -77.27 -16.16 59.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.228 0.825 . . . . 63.44 113.228 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -46.87 -52.18 14.99 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.029 0.752 . . . . 75.45 113.029 -172.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 t -60.29 -30.62 69.58 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.022 0.379 . . . . 54.34 112.022 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.74 -50.94 11.37 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.983 0.421 . . . . 74.12 111.45 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -60.46 -42.26 95.8 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.167 0.432 . . . . 72.5 112.167 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -51.43 -39.88 58.25 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 111.955 0.354 . . . . 74.45 111.955 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.94 -34.74 72.96 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 121.289 -0.481 . . . . 64.02 113.253 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.472 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 49.1 mtm -89.77 -35.23 15.84 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.335 0.588 . . . . 63.21 110.314 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 108' ' ' HIS . 14.7 tp -56.99 -42.41 80.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.616 -0.72 . . . . 72.2 111.793 -175.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.15 -15.47 63.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.961 0.726 . . . . 73.14 112.961 -177.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 0.74 19.32 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.24 0.543 . . . . 73.13 111.225 174.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 62' ' ' MET . 94.8 mt -96.23 -69.7 0.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.036 -0.529 . . . . 73.22 110.705 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 69.63 -52.08 0.62 Allowed 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 113.649 0.981 . . . . 62.34 113.649 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.42 HD13 HD22 ' A' ' 77' ' ' LEU . 2.4 mp 64.94 99.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.483 0.713 . . . . 75.31 111.478 -174.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.09 -14.89 13.82 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.306 -0.406 . . . . 72.44 112.019 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -150.56 173.45 14.09 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.625 0.25 . . . . 75.42 110.946 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.77 -35.48 68.71 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.557 0.577 . . . . 74.21 112.557 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -54.29 -42.26 69.86 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 122.311 -0.243 . . . . 62.52 111.472 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 44.3 m-20 -63.29 -43.54 97.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.094 0.473 . . . . 53.05 110.559 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.3 t -57.99 -46.7 87.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.932 -0.576 . . . . 75.4 111.189 176.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -69.61 -28.57 66.05 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.895 0.379 . . . . 70.15 111.481 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.7 m -68.33 -32.04 71.87 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.912 0.387 . . . . 64.34 110.778 174.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.472 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.6 mt -59.73 -34.26 72.71 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.732 0.301 . . . . 75.54 110.852 174.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.1 t -52.64 -35.73 55.33 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.27 -0.423 . . . . 64.25 111.576 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -58.25 -42.3 86.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.975 0.417 . . . . 75.22 110.969 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 65.9 t -73.46 -39.25 54.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.136 0.494 . . . . 73.41 110.845 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.552 ' SD ' HD12 ' A' ' 98' ' ' LEU . 18.2 mmt -56.74 -39.92 74.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.04 -0.527 . . . . 74.23 111.532 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -60.0 -35.49 61.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.818 0.342 . . . . 55.21 111.389 175.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.417 ' HA ' ' OG ' ' A' ' 86' ' ' SER . 61.6 m-70 -65.33 -39.45 92.44 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.895 0.378 . . . . 73.13 111.328 176.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.7 t -58.59 -32.83 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 120.893 0.378 . . . . 71.31 111.404 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.461 ' CE2' HD22 ' A' ' 98' ' ' LEU . 17.0 m-30 -106.68 24.9 11.93 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.504 0.557 . . . . 71.41 112.504 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.417 ' OG ' ' HA ' ' A' ' 83' ' ' HIS . 71.6 m -78.48 41.6 0.4 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.13 0.49 . . . . 70.41 111.722 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . 0.42 ' OD1' HG11 ' A' ' 89' ' ' VAL . 6.8 t70 -158.93 170.36 22.28 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.451 -0.34 . . . . 64.01 110.75 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -128.13 15.27 6.17 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.08 -0.581 . . . . 70.31 113.976 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.42 HG11 ' OD1' ' A' ' 87' ' ' ASP . 13.4 m -63.66 139.03 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 117.52 0.66 . . . . 75.55 111.857 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 29.4 p -78.57 77.14 5.06 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.217 0.532 . . . . 63.14 111.459 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -141.0 113.38 8.04 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.865 -0.607 . . . . 62.31 110.704 178.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.436 ' HE3' HG13 ' A' ' 95' ' ' ILE . 33.1 m95 -63.9 -17.82 63.59 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.653 0.263 . . . . 73.45 111.457 178.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.97 -37.82 45.64 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.589 -0.338 . . . . 64.45 113.341 177.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 94' ' ' ARG . 22.2 mmt180 -66.31 -40.74 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 122.491 -0.417 . . . . 73.43 111.43 176.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.436 HG13 ' HE3' ' A' ' 92' ' ' TRP . 37.2 mm -61.53 -44.47 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.274 0.559 . . . . 73.51 110.062 175.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 92' ' ' TRP . 51.6 t -60.89 -41.15 87.72 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.831 -0.622 . . . . 70.24 110.963 175.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.1 m -55.44 -48.13 74.94 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.747 0.308 . . . . 74.4 111.277 178.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.552 HD12 ' SD ' ' A' ' 81' ' ' MET . 19.4 tp -62.56 -54.44 39.81 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.148 0.499 . . . . 71.12 111.501 -179.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.9 mt -64.85 -38.31 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.048 -0.523 . . . . 74.2 111.497 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -63.21 -45.5 91.41 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.223 -0.444 . . . . 64.41 111.168 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.49 ' O ' HG21 ' A' ' 105' ' ' VAL . 26.5 t80 -61.05 -39.17 88.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.735 0.302 . . . . 74.34 110.568 175.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.13 -47.35 88.25 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 121.022 -0.609 . . . . 51.04 112.474 174.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.32 -35.57 81.4 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.203 0.525 . . . . 64.21 111.471 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.07 -46.73 87.8 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.023 -0.535 . . . . 70.22 110.848 177.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 101' ' ' PHE . 46.4 t -65.56 -36.43 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 116.353 -0.385 . . . . 73.11 110.613 175.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.06 -39.43 69.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.338 -0.392 . . . . 64.43 111.721 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -58.42 -44.47 89.09 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.226 0.536 . . . . 75.22 110.932 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.538 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.1 t60 -65.66 -42.62 91.16 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.128 -0.487 . . . . 74.53 110.701 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.415 HD23 ' HB ' ' A' ' 68' ' ' ILE . 97.5 mt -59.66 -50.36 74.18 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.287 -0.415 . . . . 75.22 111.086 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -56.26 -43.8 79.07 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.282 -0.417 . . . . 74.21 111.412 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.0 m -60.69 -44.04 97.02 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.166 -0.47 . . . . 64.13 112.011 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 108' ' ' HIS . 34.3 pt -89.68 16.46 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 N-CA-C 112.308 0.484 . . . . 65.12 112.308 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . 0.591 ' N ' HD21 ' A' ' 113' ' ' ASN . 0.7 OUTLIER 75.98 7.29 3.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.007 0.743 . . . . 61.54 113.007 175.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -82.72 33.69 0.43 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.551 0.34 . . . . 71.11 111.645 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -57.03 -30.76 64.49 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.043 0.449 . . . . 71.21 111.433 -176.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.405 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 58.7 m -69.62 -39.66 77.06 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.18 -0.325 . . . . 53.2 111.636 176.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.6 m -54.69 -26.31 32.78 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.074 0.398 . . . . 64.35 112.074 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.0 mt -53.89 -39.18 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 112.097 0.406 . . . . 70.45 112.097 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.23 -54.99 16.74 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 112.518 0.562 . . . . 74.24 112.518 -175.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . 0.405 ' HD2' ' O ' ' A' ' 116' ' ' SER . 20.9 Cg_endo -61.35 -26.85 82.15 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.769 1.646 . . . . 61.45 112.394 174.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.68 -47.44 75.44 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.776 -0.453 . . . . 74.41 109.776 174.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.5 -36.81 69.59 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.052 -0.522 . . . . 71.5 111.143 174.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.484 ' HA ' HD11 ' A' ' 10' ' ' LEU . 44.7 mt-10 -63.85 -44.94 91.64 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.353 -0.385 . . . . 73.44 111.159 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -60.77 -45.25 95.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.786 0.326 . . . . 64.23 111.456 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.3 mm -53.76 -52.22 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.213 0.53 . . . . 43.2 110.734 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -66.32 -33.39 75.62 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.928 -0.578 . . . . 75.13 111.818 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.27 -51.63 65.34 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.833 0.349 . . . . 73.14 110.684 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.423 HG21 ' HB2' ' A' ' 81' ' ' MET . 60.4 t -64.19 -36.73 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.017 0.437 . . . . 74.42 111.222 176.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.54 ' HG ' HD13 ' A' ' 137' ' ' LEU . 61.9 tp -57.51 -52.89 63.57 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.158 -0.474 . . . . 73.31 111.5 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 59.8 t -76.55 -24.66 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 116.426 -0.352 . . . . 72.41 111.658 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -44.74 -52.57 8.23 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.147 0.579 . . . . 74.42 112.513 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.04 -25.26 2.53 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.177 0.806 . . . . 72.11 113.177 -174.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 129' ' ' LEU . 1.1 mpmm? -85.27 11.39 10.17 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.647 -0.658 . . . . 73.05 111.847 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -47.39 -60.65 2.37 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 112.645 0.609 . . . . 64.52 112.645 -179.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.93 -37.81 88.88 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 64.02 111.752 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -62.58 -38.98 92.21 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.751 0.31 . . . . 71.11 111.484 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.54 HD13 ' HG ' ' A' ' 129' ' ' LEU . 72.2 mt -59.79 -49.58 77.17 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.803 0.335 . . . . 55.14 111.67 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.9 p -75.44 -40.13 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.037 0.384 . . . . 63.14 112.037 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 36.4 mmtm -68.29 -44.09 76.25 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.386 0.513 . . . . 73.33 112.386 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -88.66 5.69 41.91 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.861 0.362 . . . . 71.11 110.99 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 59.57 29.28 18.83 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.084 0.554 . . . . 75.42 112.164 177.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . 0.423 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 18.24 -86.93 0.0 OUTLIER Glycine 0 C--N 1.339 0.743 0 N-CA-C 115.917 1.127 . . . . 63.32 115.917 175.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.52 ' O ' HG22 ' A' ' 147' ' ' VAL . 14.1 m95 -75.09 -34.46 61.75 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.823 0.675 . . . . 73.45 112.823 -171.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -63.84 -52.49 59.88 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.04 0.448 . . . . 62.15 110.305 174.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.51 -35.6 92.14 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-N 115.863 -0.608 . . . . 50.13 112.718 178.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.17 -48.72 73.36 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.041 0.536 . . . . 64.42 111.998 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.52 HG22 ' O ' ' A' ' 143' ' ' TRP . 59.4 t -65.1 -45.23 94.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.317 0.488 . . . . 62.32 112.317 -176.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 6.6 pt-20 -73.92 -27.46 61.04 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 122.143 -0.348 . . . . 64.44 111.872 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -57.09 -50.29 73.23 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.012 0.434 . . . . 71.25 111.326 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.37 -8.93 59.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.171 -0.468 . . . . 71.44 111.22 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 7.6 t60 65.27 71.91 0.43 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.475 0.71 . . . . 72.0 112.147 176.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.454 HG12 ' HG2' ' A' ' 153' ' ' GLU . 67.1 t -114.07 -63.47 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-N 116.109 -0.496 . . . . 64.14 110.757 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.454 ' HG2' HG12 ' A' ' 152' ' ' VAL . 10.8 mm-40 -125.85 70.7 1.21 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.008 -0.542 . . . . 74.42 110.091 177.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.414 ' HB3' ' HA ' ' A' ' 148' ' ' GLU . 2.8 p-10 -97.81 170.3 9.07 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.678 0.621 . . . . 74.43 112.678 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.449 HD11 ' H ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -116.57 -16.57 10.75 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 116.177 -0.465 . . . . 71.34 112.249 -179.433 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.403 ' N ' HD21 ' A' ' 155' ' ' LEU . 44.5 mt-10 65.68 -13.93 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.593 1.331 . . . . 63.31 114.593 172.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -72.53 -104.15 0.06 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.147 -0.549 . . . . 62.42 113.881 -178.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -89.95 110.77 3.79 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 121.249 -0.501 . . . . 36.7 112.959 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -171.07 172.36 5.44 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 120.715 0.293 . . . . 75.23 111.559 -177.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 13.7 m170 -147.65 113.78 5.85 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 112.077 0.399 . . . . 74.25 112.077 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -86.6 87.31 7.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.962 0.411 . . . . 74.52 110.614 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . 0.534 ' O ' ' HB3' ' A' ' 163' ' ' HIS . 34.8 m80 -71.23 77.21 0.72 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.476 0.547 . . . . 71.31 112.476 -176.342 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . 0.534 ' HB3' ' O ' ' A' ' 162' ' ' HIS . 0.1 OUTLIER 173.38 168.82 0.16 Allowed 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 120.808 0.337 . . . . 72.42 111.38 173.536 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.8 p80 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.722 -0.656 . . . . 75.43 111.412 172.506 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.401 ' O ' ' HG3' ' A' ' 1' ' ' MET . 21.4 ptm . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.412 0.625 . . . . 74.21 111.117 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -86.86 128.33 35.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.093 -0.503 . . . . 65.02 111.482 -175.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -55.58 156.61 4.58 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.866 -0.606 . . . . 74.53 112.179 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -52.02 -45.51 64.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.406 -0.361 . . . . 74.24 111.414 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.39 -41.81 73.17 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.006 0.373 . . . . 70.05 112.006 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -66.96 -51.92 49.2 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.869 0.366 . . . . 74.15 110.694 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -59.56 -37.12 77.62 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.226 -0.443 . . . . 72.35 111.284 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -65.4 -52.1 55.75 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.992 -0.549 . . . . 74.3 111.482 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.1 m -57.32 -48.48 78.86 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.283 -0.417 . . . . 73.12 110.912 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.11 -39.84 87.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.315 -0.402 . . . . 73.14 111.3 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.0 -52.1 66.91 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 72.44 111.526 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 60.1 mt -63.65 -53.14 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 115.964 -0.562 . . . . 72.41 111.51 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.1 mt -63.0 -49.33 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.979 -0.555 . . . . 74.13 112.144 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 t -54.6 -50.82 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.85 0.357 . . . . 62.14 111.091 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 -55.09 -54.71 39.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.381 -0.372 . . . . 74.1 110.602 175.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -52.88 -44.93 67.25 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.547 0.573 . . . . 71.43 112.547 -175.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD21 ' HB3' ' A' ' 122' ' ' ALA . 9.3 mp -58.67 -51.43 69.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.643 0.259 . . . . 74.52 111.529 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -69.47 -26.31 64.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 120.75 -0.38 . . . . 72.3 111.894 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.34 -41.84 96.56 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.099 0.476 . . . . 74.33 110.652 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.584 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 25.7 mm-40 -72.26 -37.78 69.0 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.982 -0.554 . . . . 65.25 111.995 178.529 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.7 -43.65 88.51 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.92 0.391 . . . . 54.44 111.836 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.4 p -87.81 -37.81 16.25 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.847 0.356 . . . . 74.43 111.845 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.23 31.13 6.65 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.473 -0.394 . . . . 37.89 113.133 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.08 174.87 5.67 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.099 0.476 . . . . 63.5 112.222 -177.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -143.55 129.91 19.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.195 0.521 . . . . 75.43 111.785 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -105.85 153.15 22.34 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.097 -0.502 . . . . 74.3 110.857 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.7 t -149.85 11.51 0.75 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.925 0.393 . . . . 65.33 111.841 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -73.23 159.25 85.46 Favored Pre-proline 0 CA--C 1.541 0.617 0 O-C-N 122.265 -0.272 . . . . 75.24 111.582 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.42 107.15 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.413 2.076 . . . . 61.42 112.244 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 61.6 tpp -65.29 156.32 32.41 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.115 -0.493 . . . . 63.0 112.075 -175.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -77.7 -72.97 1.1 Allowed Glycine 0 CA--C 1.53 1.029 0 N-CA-C 114.27 0.468 . . . . 71.11 114.27 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -63.12 -59.45 4.76 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.587 0.588 . . . . 71.34 112.587 -173.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.653 ' HB3' ' HB2' ' A' ' 37' ' ' SER . 22.8 t -89.05 -74.67 0.46 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.41 0.522 . . . . 74.34 112.41 -177.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.485 ' O ' ' HG3' ' A' ' 38' ' ' ARG . . . 122.95 -110.06 1.48 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.344 -0.455 . . . . 55.54 112.175 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.5 -50.01 66.89 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.215 0.45 . . . . 73.25 112.215 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 86.8 m -57.08 -42.25 80.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.066 0.46 . . . . 72.43 111.394 -178.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.653 ' HB2' ' HB3' ' A' ' 33' ' ' SER . 42.7 t -64.26 -43.87 93.51 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.354 -0.385 . . . . 75.01 111.77 178.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 34' ' ' GLY . 44.3 mtp-105 -65.24 -53.45 44.29 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.771 0.286 . . . . 73.23 111.771 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.509 ' HG3' HG21 ' A' ' 147' ' ' VAL . 19.6 ptmt -56.11 -37.51 69.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.103 0.478 . . . . 74.02 111.049 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.53 -47.3 70.3 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.415 -0.357 . . . . 73.51 111.213 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.427 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.2 tp -62.76 -38.54 90.97 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.23 0.456 . . . . 74.43 112.23 -177.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.11 -34.37 61.69 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.671 0.272 . . . . 54.21 111.508 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.482 HG21 HG23 ' A' ' 152' ' ' VAL . 88.3 m -75.9 -40.22 54.82 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 111.923 0.342 . . . . 53.34 111.923 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.4 mt -53.53 -35.28 60.54 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.61 0.596 . . . . 72.12 112.61 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.427 HH21 ' HG ' ' A' ' 41' ' ' LEU . 12.7 ptp180 -77.86 -42.01 34.93 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.04 -0.412 . . . . 54.31 112.097 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.403 ' NH1' HG11 ' A' ' 152' ' ' VAL . 17.0 ptm180 -68.71 -32.53 72.39 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.05 0.389 . . . . 73.12 112.05 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.424 ' O ' HG23 ' A' ' 51' ' ' VAL . 22.3 m -94.14 -34.77 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 O-C-N 121.978 -0.451 . . . . 74.41 111.777 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.34 -48.8 49.73 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.439 -0.41 . . . . 72.42 113.605 -174.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.55 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 34.6 t70 -63.31 -36.11 82.59 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 122.438 -0.448 . . . . 70.03 110.778 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -49.96 70.71 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 121.147 -0.549 . . . . 64.44 112.488 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.445 ' HA ' HD22 ' A' ' 54' ' ' ASN . 81.7 t -57.91 -43.26 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.963 0.411 . . . . 61.44 111.161 175.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.406 ' O ' ' N ' ' A' ' 56' ' ' GLU . 43.0 mt-30 -54.51 -45.8 73.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.118 -0.492 . . . . 74.32 112.074 176.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 24.3 mmm180 -65.29 -50.01 67.35 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.077 0.769 . . . . 61.45 113.077 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.445 HD22 ' HA ' ' A' ' 51' ' ' VAL . 10.0 p30 -69.72 -30.57 68.22 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.741 -0.599 . . . . 61.41 110.911 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -82.13 -18.51 42.64 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.287 -0.415 . . . . 72.53 112.008 174.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 52' ' ' GLN . 37.1 tt0 -49.84 -48.15 51.21 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.325 0.491 . . . . 74.05 112.325 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -52.44 -33.73 45.45 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.949 0.404 . . . . 63.24 111.735 176.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.55 -54.29 5.8 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.295 -0.411 . . . . 62.14 111.585 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -56.59 -35.9 68.77 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.353 0.501 . . . . 75.44 112.353 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -56.44 -39.69 73.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.953 0.406 . . . . 44.11 110.91 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.405 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -61.52 -23.24 62.47 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 121.235 -0.507 . . . . 73.23 112.463 176.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 79.6 mtp -86.72 -55.4 3.88 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.706 0.288 . . . . 72.01 111.177 176.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.93 -33.15 66.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.783 0.66 . . . . 65.42 112.783 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.405 ' HE ' ' HA2' ' A' ' 61' ' ' GLY . 53.2 ptt85 -64.12 -30.84 71.88 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.941 -0.304 . . . . 74.44 111.543 178.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.04 -4.04 28.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 122.152 -0.343 . . . . 72.03 111.748 177.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.95 -71.86 0.66 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.068 0.461 . . . . 71.43 110.532 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 44.27 87.73 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.095 0.958 . . . . 72.13 112.517 -177.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.524 HG21 ' HB2' ' A' ' 73' ' ' ASP . 1.8 mp -70.19 115.41 9.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 115.881 -0.6 . . . . 74.35 111.701 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.56 -14.97 13.14 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.394 0.516 . . . . 75.41 112.394 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -148.52 172.6 14.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.227 -0.296 . . . . 70.12 111.075 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.6 -29.62 70.74 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.354 0.501 . . . . 64.11 112.354 -175.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.59 -39.57 88.59 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.769 0.319 . . . . 71.31 110.868 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.524 ' HB2' HG21 ' A' ' 68' ' ' ILE . 55.6 m-20 -59.65 -40.47 87.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.148 0.499 . . . . 73.24 110.562 175.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.4 t -58.53 -46.48 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 116.068 -0.515 . . . . 74.35 111.142 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.18 -32.43 73.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.91 0.386 . . . . 74.13 111.149 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -65.48 -37.71 87.61 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.932 0.396 . . . . 62.25 110.372 174.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.553 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -60.01 -37.85 80.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.353 -0.385 . . . . 72.44 110.964 174.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -53.48 -42.67 67.48 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.957 0.408 . . . . 65.14 110.851 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 mmm-85 -59.91 -46.67 88.61 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.189 -0.459 . . . . 64.33 110.474 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.2 t -58.97 -39.16 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.891 0.377 . . . . 43.31 111.168 177.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.8 mmt -58.67 -38.02 77.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.166 0.508 . . . . 71.23 110.857 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.72 -38.94 74.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.978 -0.555 . . . . 72.24 110.904 173.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -68.89 -29.74 68.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.162 -0.472 . . . . 64.51 111.493 178.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 82.3 t -63.84 -28.27 44.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 120.901 0.381 . . . . 72.45 111.165 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.512 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 52.4 m-85 -93.81 10.19 34.15 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.452 0.538 . . . . 73.34 112.452 177.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.8 t -63.52 -46.9 83.93 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 121.17 0.509 . . . . 74.04 110.961 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.67 -70.26 0.19 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.705 -0.68 . . . . 73.2 111.735 176.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.92 54.95 15.45 Favored Glycine 0 CA--C 1.532 1.134 0 N-CA-C 114.524 0.57 . . . . 63.5 114.524 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.11 151.7 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 122.128 -0.631 . . . . 75.55 111.614 171.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 67.4 p -72.82 9.71 1.07 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.16 0.8 . . . . 72.3 113.16 -176.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' A' ' 93' ' ' GLY . 50.7 m-80 -76.7 -7.73 55.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.884 0.327 . . . . 63.5 111.884 177.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.9 m95 63.86 -5.06 0.31 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.174 0.805 . . . . 72.21 113.174 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.423 ' H ' ' C ' ' A' ' 91' ' ' ASN . . . -54.78 -24.37 33.02 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.448 -0.406 . . . . 64.02 112.805 174.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.451 ' NE ' ' HA ' ' A' ' 94' ' ' ARG . 2.3 mmp_? -57.47 -44.09 84.56 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.697 0.284 . . . . 73.45 111.078 174.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.8 mm -65.61 -49.96 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.026 0.441 . . . . 74.14 110.994 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.404 HG23 ' CE1' ' A' ' 146' ' ' PHE . 61.6 t -54.29 -52.87 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.006 -0.543 . . . . 74.33 111.276 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -58.04 -42.65 85.86 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.166 -0.47 . . . . 75.11 111.662 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.512 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 29.5 tp -58.83 -54.98 40.99 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.276 0.56 . . . . 43.31 111.552 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.5 mt -69.97 -35.58 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.038 -0.528 . . . . 75.12 111.501 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.3 m -65.71 -44.73 85.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.583 -0.28 . . . . 70.43 111.185 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.461 ' O ' HG23 ' A' ' 105' ' ' VAL . 30.8 t80 -61.7 -43.43 98.87 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.676 0.274 . . . . 74.44 110.809 176.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -46.08 93.14 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 120.92 -0.657 . . . . 60.41 112.481 175.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -34.02 76.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.914 0.387 . . . . 65.11 111.519 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -65.41 -45.72 82.82 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.322 -0.399 . . . . 75.15 110.703 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.461 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 46.1 t -66.37 -36.62 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 110.085 -0.339 . . . . 54.51 110.085 175.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.74 -43.72 85.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.179 -0.464 . . . . 71.42 111.534 175.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.584 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 97.5 mttt -55.42 -46.9 76.63 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.328 0.585 . . . . 73.21 110.716 174.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.41 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.9 t60 -64.7 -34.6 78.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.13 -0.487 . . . . 71.55 111.345 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.522 HD23 ' HB ' ' A' ' 68' ' ' ILE . 80.0 mt -64.45 -49.89 69.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.496 0.189 . . . . 75.43 111.446 178.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 110' ' ' LYS . 8.3 tmtm? -57.85 -39.44 77.73 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.209 0.528 . . . . 73.22 109.802 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 m -60.52 -33.58 72.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.07 -0.514 . . . . 65.53 111.817 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.5 pt -106.28 24.97 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 112.573 0.582 . . . . 64.24 112.573 -177.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 63.52 36.77 10.94 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.735 0.642 . . . . 62.4 112.735 175.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -117.32 33.01 5.83 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.746 0.308 . . . . 73.44 111.705 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.16 -30.97 40.2 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.104 0.409 . . . . 70.01 112.104 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.9 m -67.48 -37.12 82.39 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.775 0.321 . . . . 65.04 111.054 177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.9 m -65.79 -27.2 68.1 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.093 0.405 . . . . 72.14 112.093 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.38 -39.28 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 112.476 0.547 . . . . 73.11 112.476 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -66.15 -55.54 20.49 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.604 0.594 . . . . 73.33 112.604 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.78 -26.33 81.91 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 121.736 1.624 . . . . 72.5 112.113 174.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.29 -48.22 73.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.811 -0.44 . . . . 72.44 109.811 174.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.481 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -59.14 -38.59 80.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.099 0.476 . . . . 73.21 111.226 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.39 -40.54 96.81 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 61.23 111.069 174.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.9 m -62.1 -46.66 88.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.799 0.333 . . . . 73.04 111.163 177.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 45.8 mm -54.75 -51.9 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.283 0.563 . . . . 73.21 110.97 176.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.2 m -66.62 -39.2 88.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.812 -0.631 . . . . 60.24 111.89 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 30.5 t70 -59.54 -53.58 56.49 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.78 -0.191 . . . . 75.15 110.798 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.414 ' O ' HG22 ' A' ' 132' ' ' THR . 62.3 t -61.55 -43.43 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 120.908 0.385 . . . . 65.23 111.044 178.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.566 ' HG ' HD13 ' A' ' 137' ' ' LEU . 35.6 tp -49.6 -52.48 30.05 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.922 -0.581 . . . . 72.22 111.53 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.16 -34.51 26.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.332 0.586 . . . . 62.51 111.387 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.583 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 50.7 ttt180 -58.4 -33.36 69.56 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.831 0.852 . . . . 72.54 112.872 -174.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.614 HG21 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -116.66 -14.36 10.83 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.852 1.056 . . . . 64.11 113.852 -177.683 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.833 ' HZ2' ' HB3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.33 48.9 0.9 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.537 0.94 . . . . 71.25 113.537 174.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -51.69 -60.53 3.06 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.319 0.489 . . . . 74.11 112.319 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.82 -47.23 85.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.356 -0.384 . . . . 64.42 111.961 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . 0.548 ' HB2' ' HB2' ' A' ' 133' ' ' LYS . 95.3 m95 -53.32 -38.87 63.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.873 0.323 . . . . 74.33 111.873 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.566 HD13 ' HG ' ' A' ' 129' ' ' LEU . 46.0 mt -54.05 -51.13 65.03 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.228 -0.442 . . . . 74.35 112.167 177.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.68 -43.61 25.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 O-C-N 121.94 -0.475 . . . . 63.12 112.244 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -54.21 -52.63 60.65 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.174 0.512 . . . . 70.02 111.631 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -93.77 5.12 52.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.488 . . . . 72.44 111.43 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 59.31 38.76 23.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.38 -0.373 . . . . 73.31 111.945 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -27.04 -49.33 0.06 OUTLIER Glycine 0 N--CA 1.471 1.022 0 N-CA-C 116.238 1.255 . . . . 54.35 116.238 -173.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.41 ' O ' HG22 ' A' ' 147' ' ' VAL . 13.0 m95 -67.45 -51.39 52.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 117.733 0.766 . . . . 72.32 111.716 -178.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.82 -29.07 68.9 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.905 0.383 . . . . 73.44 111.11 174.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.54 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -69.43 -37.88 79.58 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.944 -0.463 . . . . 72.41 111.944 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.404 ' CE1' HG23 ' A' ' 96' ' ' VAL . 19.1 t80 -60.45 -41.4 94.0 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.175 0.512 . . . . 71.33 110.88 173.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.509 HG21 ' HG3' ' A' ' 39' ' ' LYS . 58.4 t -70.73 -38.21 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 116.033 -0.53 . . . . 74.42 112.314 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.54 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.4 pt-20 -74.0 -40.07 63.2 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 122.274 -0.266 . . . . 71.54 111.629 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -58.24 -48.34 80.71 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.978 0.418 . . . . 73.15 111.463 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -80.75 -9.13 59.83 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.439 -0.346 . . . . 73.3 111.148 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 67.5 t60 57.93 63.02 1.89 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.458 0.647 . . . . 75.21 112.19 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.482 HG23 HG21 ' A' ' 43' ' ' THR . 87.4 t -100.33 -69.92 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.979 -0.555 . . . . 63.52 110.21 177.005 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -100.89 68.16 1.27 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 71.11 109.752 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -159.63 166.74 30.04 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.266 -0.879 . . . . 75.21 111.255 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.521 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -129.77 -10.12 4.44 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 112.673 0.619 . . . . 64.02 112.673 178.24 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -147.06 -60.22 0.28 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.746 0.307 . . . . 75.04 111.314 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . 0.471 ' HA3' ' HB2' ' A' ' 148' ' ' GLU . . . 48.84 -121.62 8.23 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 115.966 -0.561 . . . . 44.31 113.752 -178.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 174.89 147.36 6.14 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.281 -0.485 . . . . 63.41 112.616 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -88.6 -10.62 48.08 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 122.393 -0.475 . . . . 75.13 111.389 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 53.99 18.92 1.82 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.254 0.835 . . . . 74.21 113.254 173.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -77.81 88.3 4.04 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.296 0.57 . . . . 74.52 111.906 -177.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -122.37 100.48 6.96 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.578 -0.737 . . . . 62.25 109.848 174.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -159.4 147.65 17.65 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.377 -0.374 . . . . 74.13 111.055 -174.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 82.7 t60 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.825 -0.607 . . . . 75.53 110.823 174.851 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.207 0.527 . . . . 55.12 111.223 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.35 -170.59 3.41 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.07 -0.514 . . . . 71.53 110.587 -177.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -140.52 177.32 8.09 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.675 0.274 . . . . 75.03 111.547 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.6 -41.0 98.36 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.074 0.398 . . . . 74.12 112.074 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 137' ' ' LEU . 63.4 tp -60.26 -41.58 93.54 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.702 0.287 . . . . 74.34 110.615 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -57.06 -49.04 77.08 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.272 -0.422 . . . . 74.43 110.82 174.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -63.73 -43.49 96.34 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.884 0.373 . . . . 73.34 111.714 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.445 ' O ' HG13 ' A' ' 12' ' ' ILE . 54.3 tt0 -62.66 -52.24 64.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.159 0.504 . . . . 71.2 111.308 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.1 p -61.61 -44.39 97.08 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.007 -0.542 . . . . 75.34 111.09 177.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.471 ' HA ' ' HG1' ' A' ' 126' ' ' THR . 58.3 tp -53.61 -45.04 69.92 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.232 -0.44 . . . . 73.34 111.44 175.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.21 -51.43 69.02 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.715 0.293 . . . . 64.53 111.571 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 8' ' ' GLN . 62.9 mt -55.8 -51.89 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.117 0.484 . . . . 75.45 111.386 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 74.8 mt -66.72 -49.76 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.996 -0.547 . . . . 71.11 112.195 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 87.9 p -55.5 -47.84 75.56 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.88 0.371 . . . . 75.41 111.601 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 30' ' ' MET . 44.8 mtp180 -62.55 -41.94 99.22 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.406 -0.361 . . . . 73.05 111.615 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.408 ' OH ' ' HA3' ' A' ' 48' ' ' GLY . 56.0 t80 -61.07 -46.49 90.47 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.904 0.383 . . . . 75.04 111.043 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.1 mp -63.52 -34.56 78.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.47 -0.332 . . . . 64.52 111.601 177.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.486 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -62.95 -54.06 44.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.62 0.248 . . . . 65.44 111.477 176.552 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 42.5 mm-40 -63.0 -35.33 79.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.097 0.475 . . . . 74.01 111.624 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 71.6 mm-40 -72.37 -28.07 62.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.839 0.352 . . . . 73.04 111.724 175.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.582 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -72.89 -39.16 66.61 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 121.224 0.535 . . . . 74.2 110.928 175.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.5 p -87.62 -20.12 26.81 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.92 -0.582 . . . . 62.44 111.849 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.84 40.13 9.79 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 121.654 -0.308 . . . . 39.22 113.779 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.421 ' O ' ' HB3' ' A' ' 19' ' ' GLU . . . -156.11 -163.12 1.4 Allowed 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.351 -0.499 . . . . 62.4 112.164 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -132.56 147.78 52.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.064 -0.516 . . . . 62.03 110.116 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.81 -172.84 2.19 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.823 0.821 . . . . 63.53 112.148 -178.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.4 t -150.44 41.6 0.8 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 114.899 -1.046 . . . . 73.34 109.288 174.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -92.53 141.03 24.19 Favored Pre-proline 0 CA--C 1.541 0.6 0 CA-C-N 115.113 -0.949 . . . . 53.41 111.908 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 143.03 97.34 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.759 2.306 . . . . 71.11 112.897 175.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.402 ' HG2' ' NH1' ' A' ' 15' ' ' ARG . 64.7 mtp -94.59 179.0 5.41 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.942 0.401 . . . . 75.1 112.036 -178.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.65 -136.47 1.41 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 121.49 -0.386 . . . . 71.43 114.015 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -42.96 95.7 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 122.39 -0.477 . . . . 73.34 111.719 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.4 p -71.36 133.31 45.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.602 -0.272 . . . . 63.24 111.502 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.2 -95.17 2.22 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.19 -0.529 . . . . 60.35 113.167 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.1 70.21 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.996 0.739 . . . . 65.42 112.996 -173.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.1 m -54.7 -54.18 45.24 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 120.955 0.407 . . . . 73.54 111.856 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.2 m -71.85 -31.48 66.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.461 -0.336 . . . . 72.43 111.867 -177.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.3 tpt85 -64.02 -48.02 77.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 120.655 0.264 . . . . 65.31 111.438 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.457 ' HZ3' ' CG ' ' A' ' 154' ' ' ASP . 6.1 ptmm? -76.2 -27.78 57.01 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.71 0.291 . . . . 65.2 111.41 178.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.57 -52.97 48.34 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.837 0.351 . . . . 61.22 110.948 174.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.5 tp -61.39 -38.27 86.43 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.176 0.512 . . . . 74.34 110.816 176.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.27 -40.52 90.67 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.92 -0.582 . . . . 71.21 110.827 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.54 HG21 HG21 ' A' ' 152' ' ' VAL . 93.6 m -69.64 -45.54 68.24 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.106 -0.497 . . . . 74.15 111.202 176.38 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.2 mt -54.28 -46.34 72.68 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.504 0.557 . . . . 72.21 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 45' ' ' ARG . 6.5 ptp180 -65.58 -34.11 77.48 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.152 -0.342 . . . . 73.12 111.447 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -73.07 -44.84 60.02 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 111.941 0.349 . . . . 74.41 111.941 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.412 ' O ' HG23 ' A' ' 51' ' ' VAL . 33.5 m -79.72 -34.12 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.793 0.33 . . . . 74.13 111.329 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.408 ' HA3' ' OH ' ' A' ' 16' ' ' TYR . . . -66.12 -39.35 94.59 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 121.459 -0.401 . . . . 53.3 112.859 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.99 -45.63 61.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.974 0.416 . . . . 72.35 111.417 174.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.44 -51.16 10.09 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 120.985 -0.626 . . . . 61.12 112.987 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.5 t -57.44 -53.48 43.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.372 0.508 . . . . 50.11 112.372 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -59.88 -44.81 93.99 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.204 0.446 . . . . 64.35 112.204 -177.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -65.44 -33.72 76.61 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.098 0.777 . . . . 74.11 113.098 -175.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -84.6 -34.14 23.21 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.336 -0.853 . . . . 74.42 111.062 176.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -75.47 -18.18 59.93 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.213 0.449 . . . . 72.31 112.213 177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.86 -55.19 10.37 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.644 0.609 . . . . 73.44 112.644 -174.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.8 t -58.93 -35.25 72.79 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.141 0.422 . . . . 62.22 112.141 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.72 -53.27 23.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.828 0.346 . . . . 74.11 111.649 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -63.92 -33.01 74.74 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.532 -0.303 . . . . 72.32 111.736 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.512 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 41.4 mm-40 -47.76 -46.79 30.56 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.554 0.216 . . . . 63.41 111.297 176.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.3 -41.07 61.64 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 121.233 -0.508 . . . . 74.11 112.913 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.445 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.9 mtp -70.51 -40.88 73.25 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.037 0.446 . . . . 75.31 111.081 178.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -62.2 -26.89 68.61 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.494 -0.321 . . . . 74.44 111.799 176.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 33.4 mtm180 -60.77 -26.57 67.33 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.233 0.457 . . . . 73.43 112.233 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' ' 62' ' ' MET . 56.3 pttt -94.71 -8.98 36.19 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.863 0.363 . . . . 52.23 111.209 176.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.496 HD11 HD21 ' A' ' 77' ' ' LEU . 93.8 mt -105.92 -84.78 0.5 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.581 0.585 . . . . 71.22 112.581 -173.284 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.75 -22.41 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.529 0.937 . . . . 73.25 113.529 -173.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.457 ' H ' ' C ' ' A' ' 66' ' ' LEU . 2.4 mp 59.34 95.65 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.659 0.783 . . . . 75.32 112.456 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.79 -8.65 18.62 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.604 . . . . 74.34 111.443 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.433 ' N ' HD21 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.35 -179.71 7.61 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.377 -0.374 . . . . 71.22 110.674 175.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 34.8 tt0 -59.74 -37.26 78.47 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.837 0.31 . . . . 65.44 111.837 -178.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -54.28 -36.13 63.32 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 111.863 0.32 . . . . 72.24 111.863 -174.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -61.75 -44.39 97.0 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.317 0.58 . . . . 73.54 110.618 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.03 -36.97 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 121.265 0.555 . . . . 75.3 110.828 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.6 mmmt -65.13 -31.34 72.49 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.025 0.44 . . . . 71.32 110.577 176.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -67.78 -40.39 83.97 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.059 0.456 . . . . 74.53 110.609 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.565 ' O ' ' HG2' ' A' ' 81' ' ' MET . 96.7 mt -55.91 -40.3 72.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.133 -0.485 . . . . 71.22 110.93 175.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.8 t -54.86 -44.5 74.06 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.018 0.437 . . . . 64.5 111.069 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -57.92 -44.23 86.75 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.147 -0.479 . . . . 74.42 110.803 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.422 ' O ' HG23 ' A' ' 84' ' ' VAL . 57.6 t -61.08 -41.81 90.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.207 -0.452 . . . . 71.14 111.131 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.4 mmt -57.7 -43.89 85.47 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.07 0.462 . . . . 62.12 111.241 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 68.6 mt -56.13 -41.27 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.232 0.539 . . . . 73.23 110.87 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.76 -26.35 59.71 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.447 0.536 . . . . 72.21 112.447 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 80' ' ' VAL . 78.8 t -55.91 -33.09 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.135 0.493 . . . . 74.54 111.178 174.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.494 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.3 m-85 -81.98 14.95 2.49 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.485 0.55 . . . . 72.31 112.485 179.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.8 t -58.8 -37.03 75.46 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.931 0.396 . . . . 72.43 110.975 176.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.02 85.37 0.09 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.426 0.632 . . . . 72.24 112.08 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.65 54.59 4.64 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 116.05 -0.523 . . . . 72.03 112.11 174.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.0 m -114.57 165.8 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 120.853 0.359 . . . . 74.24 111.479 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 m -78.82 69.25 4.96 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.366 0.603 . . . . 72.0 111.141 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -148.04 158.87 44.3 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.931 -0.577 . . . . 74.11 111.409 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.1 m95 -106.11 -5.18 19.59 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.198 -0.455 . . . . 73.33 111.413 176.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.46 -35.79 51.96 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 121.428 -0.415 . . . . 63.1 113.225 177.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -54.82 -40.41 69.53 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 111.998 0.37 . . . . 72.24 111.998 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 44.8 mm -66.64 -46.47 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 120.905 0.383 . . . . 74.32 110.839 177.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.7 t -57.93 -43.33 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 120.978 0.418 . . . . 74.14 110.838 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.1 m -59.82 -42.25 93.09 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.168 -0.469 . . . . 65.21 111.239 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.506 HD11 ' SD ' ' A' ' 81' ' ' MET . 29.1 tp -59.54 -54.67 43.82 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.258 0.552 . . . . 63.43 111.67 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.4 mt -69.7 -39.99 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 115.991 -0.549 . . . . 73.41 111.873 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.2 p -63.45 -45.76 89.38 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.593 -0.276 . . . . 75.34 111.743 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.66 -43.27 93.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.795 0.331 . . . . 72.14 111.018 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.43 -45.47 92.93 Favored Glycine 0 CA--C 1.529 0.906 0 C-N-CA 120.904 -0.665 . . . . 61.4 112.314 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.34 -35.32 80.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.113 0.482 . . . . 73.23 111.647 177.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -64.75 -40.82 95.93 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.151 -0.477 . . . . 73.14 111.242 178.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.457 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 59.9 t -71.9 -38.44 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 120.838 0.352 . . . . 72.12 110.673 176.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.43 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.68 0.622 . . . . 73.13 112.68 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.619 ' HB3' ' HZ2' ' A' ' 107' ' ' LYS . 0.9 OUTLIER -61.27 -38.89 88.38 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.849 0.357 . . . . 71.51 111.494 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.43 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.4 t60 -65.59 -36.71 84.54 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.746 0.308 . . . . 75.22 110.703 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 81.4 mt -62.95 -50.44 70.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.489 -0.323 . . . . 60.12 111.859 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.836 0.35 . . . . 51.03 111.075 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.2 m -57.48 -37.82 73.53 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.403 -0.362 . . . . 63.32 111.737 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.6 pt -97.56 21.66 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 120.913 0.387 . . . . 75.34 111.646 177.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 68.75 6.81 5.75 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.637 0.977 . . . . 73.11 113.637 174.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -82.87 40.92 0.71 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.281 0.474 . . . . 63.12 112.281 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.0 -33.01 72.58 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.859 -0.526 . . . . 74.31 111.27 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 38.8 m -56.74 -28.09 60.51 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.519 -0.31 . . . . 73.31 111.435 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.9 m -79.24 -27.04 42.4 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.769 0.318 . . . . 74.43 111.834 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.5 mt -59.73 -41.39 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.482 0.549 . . . . 74.32 112.482 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -62.2 -56.42 31.26 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 112.402 0.519 . . . . 65.4 112.402 -178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.19 -30.23 90.82 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.846 1.697 . . . . 62.33 112.419 176.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -64.14 -50.18 69.22 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 109.66 -0.496 . . . . 64.02 109.66 174.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.75 -41.54 77.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.008 -0.542 . . . . 74.34 111.381 177.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -61.91 -46.19 90.46 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.448 -0.342 . . . . 73.32 111.009 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.9 m -56.4 -38.34 71.39 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.206 0.447 . . . . 62.14 112.206 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.402 HG22 ' HG ' ' A' ' 98' ' ' LEU . 41.4 mm -57.2 -53.88 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.204 0.526 . . . . 72.41 111.014 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' THR . . . . . 0.471 ' HG1' ' HA ' ' A' ' 10' ' ' LEU . 38.3 m -71.41 -33.76 69.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.935 -0.575 . . . . 71.54 111.453 179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -59.82 -51.58 69.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.165 -0.471 . . . . 73.45 111.163 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.574 ' O ' HG23 ' A' ' 132' ' ' THR . 63.1 t -64.29 -48.89 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 120.87 0.367 . . . . 64.45 110.633 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.577 ' HG ' HD11 ' A' ' 137' ' ' LEU . 59.8 tp -49.21 -52.65 25.58 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.878 -0.601 . . . . 73.34 111.817 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.555 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -66.28 -52.24 49.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.231 -0.441 . . . . 55.01 111.519 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 131' ' ' ARG . 42.3 ttm105 -48.18 -46.08 34.42 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.89 0.7 . . . . 71.13 112.89 -176.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.574 HG23 ' O ' ' A' ' 128' ' ' VAL . 3.8 t -99.93 -28.76 12.93 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.082 1.141 . . . . 73.53 114.082 -173.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.505 ' HD2' HG22 ' A' ' 132' ' ' THR . 1.4 mptp? -131.82 31.05 4.27 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.529 0.937 . . . . 75.04 113.529 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.555 ' HD3' HG13 ' A' ' 130' ' ' VAL . 37.3 tpt85 -54.5 -45.96 73.37 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.018 0.437 . . . . 73.43 111.754 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.11 -50.85 72.47 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.049 -0.523 . . . . 62.35 111.703 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -57.79 -37.09 73.1 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 111.956 0.354 . . . . 74.21 111.956 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.577 HD11 ' HG ' ' A' ' 129' ' ' LEU . 77.6 mt -57.16 -48.56 78.4 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.11 0.411 . . . . 74.32 112.11 177.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.19 -36.83 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 122.156 -0.34 . . . . 63.41 111.753 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.45 -53.36 59.06 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.009 0.433 . . . . 75.1 111.865 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -93.89 7.01 46.59 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.118 0.414 . . . . 73.21 112.118 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 52.97 54.51 10.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.017 0.437 . . . . 72.53 110.509 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -30.94 -56.69 0.27 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 115.964 1.146 . . . . 71.21 115.964 -170.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.483 ' O ' HG22 ' A' ' 147' ' ' VAL . 18.6 m95 -69.87 -44.19 70.31 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 117.388 0.594 . . . . 74.51 112.548 -173.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.65 -51.2 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.927 0.394 . . . . 74.43 111.14 174.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . 0.424 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.14 -38.37 85.52 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 116.059 -0.519 . . . . 61.14 112.803 178.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -57.83 -53.79 54.28 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.037 0.446 . . . . 71.32 111.527 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 143' ' ' TRP . 29.8 t -66.02 -42.5 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.135 0.42 . . . . 72.44 112.135 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.424 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.3 pt-20 -70.43 -34.15 72.15 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 122.168 -0.332 . . . . 63.2 111.544 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -62.2 -47.48 84.25 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.994 0.426 . . . . 73.34 110.816 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -79.78 -4.63 52.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.304 -0.407 . . . . 74.24 111.391 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.7 p80 43.02 39.75 1.94 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.109 0.963 . . . . 71.22 112.964 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.54 HG21 HG21 ' A' ' 43' ' ' THR . 56.1 t -65.05 -65.42 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.581 -0.281 . . . . 75.54 111.39 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.402 ' HG2' HG11 ' A' ' 152' ' ' VAL . 11.6 mm-40 -98.42 4.77 48.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.771 0.319 . . . . 72.53 111.342 178.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.457 ' CG ' ' HZ3' ' A' ' 39' ' ' LYS . 3.7 m-20 -135.11 175.99 9.08 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.451 0.644 . . . . 70.24 111.917 -174.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -138.43 9.0 2.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.399 -0.819 . . . . 74.04 109.967 171.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -93.88 21.63 6.42 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.393 -0.821 . . . . 74.31 112.271 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -151.67 -168.96 16.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.963 -0.637 . . . . 73.5 113.194 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 85.47 -79.91 1.85 Allowed Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.036 -0.602 . . . . 73.3 112.729 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -83.22 85.46 7.2 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.386 0.612 . . . . 72.35 110.169 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -131.72 134.31 45.76 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.675 -0.693 . . . . 75.23 111.375 -173.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -69.83 125.07 25.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.792 -0.448 . . . . 72.11 109.792 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -54.35 -53.65 51.07 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.652 0.612 . . . . 73.42 112.652 -172.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -86.88 93.57 9.34 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.961 0.41 . . . . 74.53 111.467 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.759 -0.639 . . . . 70.0 111.125 176.682 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 tpp . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 121.16 0.505 . . . . 72.21 111.321 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.428 ' HB2' ' CG ' ' A' ' 6' ' ' TYR . 0.1 OUTLIER -72.98 177.48 4.92 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.913 0.708 . . . . 72.3 112.913 -177.711 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -105.03 164.9 11.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.562 -0.744 . . . . 73.21 111.025 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.53 -46.18 77.1 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.016 0.436 . . . . 73.05 111.26 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.55 -34.11 70.67 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.109 -0.496 . . . . 63.14 110.773 177.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.428 ' CG ' ' HB2' ' A' ' 2' ' ' GLU . 11.1 t80 -67.23 -43.4 82.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.963 -0.562 . . . . 75.31 110.536 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -67.85 -43.63 79.01 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.189 0.44 . . . . 74.32 112.189 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -58.0 -50.85 71.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.208 0.528 . . . . 64.35 110.693 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.3 p -64.04 -51.89 62.02 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.907 -0.588 . . . . 63.25 111.544 178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 61.7 tp -51.98 -42.73 63.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 111.857 0.317 . . . . 74.43 111.857 177.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -57.78 -52.83 63.87 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.124 0.488 . . . . 74.33 111.044 177.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.51 -48.38 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.851 -0.613 . . . . 71.44 111.897 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.452 HG21 HG22 ' A' ' 99' ' ' ILE . 75.3 mt -64.09 -52.52 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.359 -0.382 . . . . 65.34 111.968 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.7 p -52.78 -47.72 67.33 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.807 0.337 . . . . 73.01 111.637 -178.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 74.6 mtt180 -57.52 -51.26 70.17 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.648 -0.251 . . . . 63.13 110.8 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -53.22 -39.27 63.63 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.02 0.378 . . . . 72.43 112.02 -177.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.517 HD21 ' HB3' ' A' ' 122' ' ' ALA . 10.9 mp -62.93 -46.14 89.17 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.57 0.211 . . . . 73.11 111.57 176.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.67 -34.69 78.88 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.118 -0.364 . . . . 70.31 111.356 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.0 mm-40 -56.63 -51.76 67.47 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.306 0.574 . . . . 73.31 111.114 176.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -77.97 -23.42 48.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.962 -0.563 . . . . 71.33 112.495 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.01 -48.27 21.66 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.978 0.418 . . . . 64.21 111.59 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.422 HG21 ' HE3' ' A' ' 110' ' ' LYS . 32.8 p -92.07 -38.77 12.01 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.095 0.405 . . . . 71.31 112.095 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.88 16.4 63.44 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 121.217 -0.516 . . . . 65.15 112.696 -175.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.43 114.54 15.68 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.7 -0.294 . . . . 51.41 111.373 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -67.33 151.88 46.69 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.674 0.62 . . . . 72.21 112.674 -176.564 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -99.86 -168.78 1.65 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.003 0.43 . . . . 74.14 111.06 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -152.28 29.13 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.208 0.528 . . . . 52.03 111.565 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -76.04 150.52 83.42 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-O 120.958 0.409 . . . . 62.41 111.76 -178.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.46 130.0 33.68 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.701 2.267 . . . . 63.13 112.765 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 20.8 mmt -69.92 158.44 35.57 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.736 0.303 . . . . 73.12 111.677 176.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.42 -81.26 0.08 OUTLIER Glycine 0 CA--C 1.531 1.047 0 C-N-CA 121.136 -0.555 . . . . 36.97 112.927 176.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -137.23 159.16 42.71 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.515 -0.403 . . . . 70.25 111.375 176.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.4 m 63.55 88.19 0.1 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.379 0.672 . . . . 74.0 111.398 -174.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.9 -58.84 8.95 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-N 115.808 -0.633 . . . . 36.97 113.122 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.77 -50.11 71.33 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 111.837 0.31 . . . . 53.1 111.837 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -61.68 -53.25 58.59 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.015 0.376 . . . . 65.24 112.015 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.2 m -60.83 -33.06 72.46 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.842 0.353 . . . . 64.5 111.635 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 -68.03 -56.53 8.57 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.841 0.353 . . . . 73.44 111.408 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HG3' HG21 ' A' ' 147' ' ' VAL . 16.9 ptmt -64.41 -32.05 73.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.403 -0.362 . . . . 72.03 111.518 -177.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -47.5 78.9 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.842 0.354 . . . . 70.43 111.089 175.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.49 ' HG ' HH21 ' A' ' 45' ' ' ARG . 51.7 tp -64.67 -38.0 89.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.286 0.476 . . . . 73.02 112.286 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.506 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 12.1 pt-20 -75.79 -34.67 60.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.002 -0.436 . . . . 73.03 111.415 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.532 ' OG1' HG23 ' A' ' 152' ' ' VAL . 56.8 m -67.47 -38.67 84.75 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.083 -0.386 . . . . 73.4 111.138 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.64 -43.87 69.12 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.925 0.342 . . . . 74.41 111.925 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.49 HH21 ' HG ' ' A' ' 41' ' ' LEU . 16.0 ptp180 -78.72 -36.65 43.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.828 0.346 . . . . 74.22 111.176 177.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.476 ' NH1' HG11 ' A' ' 152' ' ' VAL . 32.4 ttt180 -57.12 -43.13 82.03 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.169 0.587 . . . . 74.42 112.163 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 43' ' ' THR . 19.3 m -101.59 -33.96 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.855 0.36 . . . . 63.52 111.642 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.453 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -61.96 -35.9 92.07 Favored Glycine 0 C--N 1.333 0.375 0 CA-C-N 116.317 -0.401 . . . . 75.11 113.614 -177.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 28.4 t70 -54.68 -55.49 29.13 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.064 0.459 . . . . 75.3 110.981 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.05 99.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.13 -0.557 . . . . 53.41 112.752 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 47' ' ' VAL . 65.6 t -57.28 -46.98 85.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 O-C-N 122.659 -0.318 . . . . 70.22 111.504 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.9 mt-30 -55.86 -46.66 78.18 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.655 0.264 . . . . 44.15 111.158 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 35.3 mtp85 -60.92 -41.12 95.55 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.179 0.437 . . . . 65.22 112.179 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -71.48 -37.57 71.29 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.242 0.544 . . . . 74.02 111.496 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -83.83 -19.05 35.62 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.646 0.61 . . . . 64.31 112.646 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 38.9 tt0 -49.17 -55.3 12.85 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.298 0.481 . . . . 64.32 112.298 -174.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -52.17 -34.78 46.5 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.904 0.383 . . . . 64.52 112.0 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.47 -42.39 59.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.87 0.367 . . . . 72.43 111.719 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -69.87 -34.36 73.48 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.12 0.415 . . . . 73.32 112.12 -178.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 84.0 mm-40 -51.04 -38.24 50.24 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.084 0.469 . . . . 71.14 111.322 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.491 ' HA2' ' NH1' ' A' ' 64' ' ' ARG . . . -58.67 -33.0 70.62 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.01 -0.541 . . . . 75.42 113.861 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.477 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 71.0 mtm -90.05 -45.31 9.24 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.293 -0.533 . . . . 75.32 111.717 178.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.22 -29.52 61.11 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.517 0.562 . . . . 65.02 112.517 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.491 ' NH1' ' HA2' ' A' ' 61' ' ' GLY . 18.3 ptt-85 -65.24 -19.0 65.76 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.748 0.309 . . . . 63.12 111.737 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.0 3.46 8.69 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.881 0.697 . . . . 64.25 112.881 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 62' ' ' MET . 82.5 mt -90.25 -77.32 0.4 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.904 0.335 . . . . 73.02 111.904 178.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 52.52 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.654 0.74 . . . . 73.43 112.49 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.507 HG21 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -77.86 99.12 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 115.62 -0.718 . . . . 73.52 110.532 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.441 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.86 -9.87 16.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.961 -0.563 . . . . 72.55 112.194 -176.992 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.441 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -157.46 173.75 16.43 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.845 0.355 . . . . 61.5 111.431 173.266 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -56.53 -39.67 73.77 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.16 0.8 . . . . 64.32 113.16 -171.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -54.34 -34.46 61.1 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.739 0.304 . . . . 52.03 111.344 -177.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.507 ' HB2' HG21 ' A' ' 68' ' ' ILE . 49.3 m-20 -63.39 -46.25 87.31 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.025 0.441 . . . . 60.11 110.849 176.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 80.3 t -58.28 -46.07 89.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.378 0.608 . . . . 73.22 110.512 176.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.578 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 6.6 mtpm? -64.16 -28.0 69.46 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.765 -0.652 . . . . 75.5 110.915 177.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 55.4 m -73.03 -36.36 66.95 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.897 0.379 . . . . 72.44 110.789 174.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.453 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -61.72 -37.09 82.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.482 -0.326 . . . . 74.43 110.896 175.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 t -52.78 -39.52 62.35 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.188 0.518 . . . . 71.53 111.135 176.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -62.6 -38.78 91.53 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.926 -0.579 . . . . 72.42 110.896 177.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.71 -42.89 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.876 0.369 . . . . 73.33 110.74 175.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 20.7 mmt -54.96 -40.98 70.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.017 -0.538 . . . . 74.34 111.256 178.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.2 -43.05 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.091 -0.504 . . . . 72.11 111.013 175.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -67.06 -28.77 68.47 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.087 -0.506 . . . . 71.34 112.064 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 91.8 t -55.46 -35.05 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.112 0.482 . . . . 55.42 111.366 177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.511 ' HA ' ' NH2' ' A' ' 94' ' ' ARG . 73.8 m-85 -95.54 29.22 2.66 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.128 0.418 . . . . 73.55 112.128 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 67.0 p -74.59 -43.84 53.64 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.271 0.471 . . . . 61.11 112.271 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.32 157.41 37.07 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.069 0.461 . . . . 71.33 111.812 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.38 66.38 0.3 Allowed Glycine 0 CA--C 1.527 0.815 0 N-CA-C 114.477 0.551 . . . . 43.11 114.477 -172.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.415 HG12 ' HD2' ' A' ' 94' ' ' ARG . 10.8 p -135.38 143.99 35.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 122.453 -0.439 . . . . 54.41 111.01 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.9 t -94.63 28.5 2.62 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.088 0.773 . . . . 73.31 113.088 -172.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.81 123.81 24.12 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.987 -0.445 . . . . 61.21 111.436 178.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.458 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 94.0 m95 -61.86 -17.81 57.82 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 111.875 0.324 . . . . 73.32 111.875 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.74 -24.59 49.12 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.276 -0.488 . . . . 73.0 112.999 174.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.511 ' NH2' ' HA ' ' A' ' 85' ' ' PHE . 73.1 mtp180 -66.65 -43.04 85.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.938 0.399 . . . . 74.15 110.452 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.72 -43.44 95.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.217 0.532 . . . . 74.41 110.297 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.1 t -60.54 -42.71 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.929 -0.578 . . . . 54.32 110.959 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.9 m -60.87 -42.56 98.13 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.93 0.395 . . . . 73.54 111.162 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.482 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 27.0 tp -59.66 -54.64 44.1 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.263 0.554 . . . . 73.35 111.515 177.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . 0.452 HG22 HG21 ' A' ' 13' ' ' ILE . 59.4 mt -69.1 -37.84 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-N 116.073 -0.512 . . . . 72.05 111.746 -177.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.5 p -65.6 -40.37 92.6 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.33 -0.231 . . . . 72.0 111.311 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -62.22 -42.3 99.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.666 0.27 . . . . 65.34 110.506 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.76 -47.2 87.44 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.914 -0.66 . . . . 44.55 112.219 174.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.441 ' O ' ' HG3' ' A' ' 107' ' ' LYS . . . -66.42 -34.65 78.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.946 0.403 . . . . 50.22 111.582 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -64.87 -45.51 85.7 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.044 0.449 . . . . 73.54 110.679 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.75 -37.49 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 116.335 -0.393 . . . . 70.25 110.584 175.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.74 -40.85 66.49 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.793 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 93.7 mttt -57.28 -49.36 76.34 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.111 0.482 . . . . 75.2 110.651 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.429 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.5 t60 -64.68 -33.2 75.39 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.103 -0.499 . . . . 72.43 110.996 178.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.502 HD23 ' HB ' ' A' ' 68' ' ' ILE . 76.6 mt -62.95 -50.78 69.47 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.619 -0.264 . . . . 73.34 111.44 177.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.422 ' HE3' HG21 ' A' ' 22' ' ' THR . 61.6 tttm -65.39 -27.41 68.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.984 0.421 . . . . 70.41 110.609 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.1 m -65.66 -31.67 72.82 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.115 -0.493 . . . . 73.44 111.382 175.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.8 pt -108.77 36.34 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-O 120.777 0.322 . . . . 73.3 111.455 177.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 p30 47.7 20.41 0.2 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.225 1.194 . . . . 51.4 114.225 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.17 35.71 0.81 Allowed 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.203 0.525 . . . . 74.53 110.879 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -56.69 -39.24 73.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.008 -0.542 . . . . 73.34 112.105 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 79.1 p -65.37 -27.63 68.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.491 -0.322 . . . . 65.02 111.643 178.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.5 m -68.57 -26.4 65.38 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.545 0.338 . . . . 74.1 111.81 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.23 -40.78 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 N-CA-C 112.62 0.6 . . . . 60.32 112.62 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.95 -52.52 23.87 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 112.852 0.686 . . . . 51.42 112.852 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.14 -27.14 84.27 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.88 1.72 . . . . 64.45 112.159 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.65 -46.36 82.86 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 109.831 -0.433 . . . . 64.41 109.831 172.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.517 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -58.07 -39.4 78.43 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.02 0.438 . . . . 61.15 111.132 174.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.62 -43.17 97.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.405 -0.361 . . . . 64.0 110.943 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.2 m -58.71 -47.47 84.44 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.886 0.374 . . . . 72.34 111.015 177.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.8 mm -52.7 -52.51 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.44 0.638 . . . . 63.41 111.087 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.8 m -67.04 -38.41 85.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.421 -0.809 . . . . 70.35 112.261 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.07 -51.15 65.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.674 0.273 . . . . 65.33 110.889 -178.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 67.0 t -60.4 -33.85 55.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.371 0.605 . . . . 65.42 110.944 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.533 ' HG ' HD13 ' A' ' 137' ' ' LEU . 38.8 tp -66.12 -54.04 30.52 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.999 -0.546 . . . . 74.53 111.917 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.432 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 61.5 t -76.49 -29.63 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 111.941 0.349 . . . . 65.2 111.941 -176.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.56 -49.94 66.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.989 0.423 . . . . 63.21 112.122 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.524 ' OG1' ' HD3' ' A' ' 133' ' ' LYS . 10.5 p -109.99 -39.23 5.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 75.32 112.402 -175.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.524 ' HD3' ' OG1' ' A' ' 132' ' ' THR . 2.7 mppt? -82.46 10.79 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.294 0.479 . . . . 72.34 112.294 -177.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 20.9 tpt180 -45.71 -61.24 1.79 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.849 0.685 . . . . 74.43 112.849 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.05 -49.06 79.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.071 0.462 . . . . 64.34 111.363 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -60.68 -36.93 79.97 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.156 -0.475 . . . . 73.2 111.996 -177.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.533 HD13 ' HG ' ' A' ' 129' ' ' LEU . 29.7 mt -59.35 -54.48 46.26 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.685 0.254 . . . . 73.22 111.685 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.8 p -71.11 -38.44 71.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 112.027 0.38 . . . . 54.15 112.027 -178.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -63.12 -46.02 89.27 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.122 0.416 . . . . 72.12 112.122 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -94.65 6.23 49.48 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.995 0.426 . . . . 73.43 111.317 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 62.05 26.63 16.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.92 -0.582 . . . . 63.45 112.281 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . 0.458 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 25.83 -83.09 0.0 OUTLIER Glycine 0 N--CA 1.468 0.787 0 N-CA-C 115.903 1.121 . . . . 73.32 115.903 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -75.34 -38.17 60.31 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.124 0.416 . . . . 62.14 112.124 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.506 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 20.0 m-20 -64.69 -48.08 76.01 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.922 -0.399 . . . . 75.53 109.922 173.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.53 93.19 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.148 -0.549 . . . . 64.44 112.492 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.05 -49.34 74.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.921 0.488 . . . . 71.43 111.164 174.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.51 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.5 t -68.89 -35.96 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 116.351 -0.386 . . . . 62.43 111.281 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 46.0 mt-10 -57.5 -47.54 81.65 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.088 0.47 . . . . 54.44 111.154 176.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -60.04 -48.96 79.53 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.077 -0.511 . . . . 75.44 111.728 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -83.94 -3.63 58.1 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.157 0.428 . . . . 74.22 112.157 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.4 p80 44.59 86.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.92 1.082 . . . . 72.14 113.92 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.532 HG23 ' OG1' ' A' ' 43' ' ' THR . 81.8 t -98.67 -50.26 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 121.219 0.533 . . . . 74.11 110.691 176.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -105.19 -15.23 15.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.837 0.827 . . . . 75.23 109.572 170.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.12 70.28 10.56 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.879 -1.055 . . . . 71.54 110.851 -174.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -23.82 6.37 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.454 0.909 . . . . 44.32 113.454 -174.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -74.76 -5.79 45.3 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.861 0.689 . . . . 72.21 112.861 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -76.1 42.32 1.62 Allowed Glycine 0 CA--C 1.533 1.17 0 C-N-CA 121.32 -0.467 . . . . 73.04 114.265 -177.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -86.09 104.24 2.86 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.3 -0.476 . . . . 62.14 111.922 176.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 18.2 p80 -115.4 99.4 7.35 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.638 0.607 . . . . 64.22 112.638 -174.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -91.13 -26.48 19.09 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.982 0.42 . . . . 74.22 110.575 174.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -63.38 113.91 3.53 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.987 -0.552 . . . . 75.51 111.51 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -92.44 108.73 20.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.213 -0.449 . . . . 75.54 111.982 -176.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 34.3 p80 -61.55 176.65 0.47 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 116.538 -0.301 . . . . 74.42 110.836 172.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 48.9 t60 . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.331 -0.842 . . . . 74.41 110.783 176.389 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 120.98 0.419 . . . . 72.13 110.625 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -106.63 143.14 35.16 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.969 0.414 . . . . 75.11 111.305 -175.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.08 162.93 28.75 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.194 0.813 . . . . 65.31 113.194 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -49.82 -47.57 51.33 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.334 -0.848 . . . . 74.31 111.61 175.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.424 HD23 ' HB2' ' A' ' 137' ' ' LEU . 66.3 tp -69.54 -36.54 76.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.815 -0.63 . . . . 74.34 111.413 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -68.12 -44.56 75.85 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.236 -0.438 . . . . 73.22 111.297 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.603 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 24.8 mmm180 -71.94 -32.77 67.66 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.224 0.453 . . . . 74.23 112.224 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.504 ' NE2' ' HB2' ' A' ' 33' ' ' SER . 6.7 tp60 -64.16 -51.85 61.83 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.146 0.498 . . . . 73.45 111.07 174.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 p -61.68 -54.51 41.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.093 -0.503 . . . . 73.41 111.673 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.498 HD22 HH11 ' A' ' 7' ' ' ARG . 50.6 tp -54.35 -37.96 65.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.444 -0.344 . . . . 64.42 111.832 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.603 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 1.9 tm-20 -60.28 -53.43 57.79 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.263 0.554 . . . . 73.21 111.273 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.44 HD11 ' HB1' ' A' ' 40' ' ' ALA . 65.0 mt -63.5 -47.76 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.811 -0.631 . . . . 75.52 111.342 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.451 ' O ' HD11 ' A' ' 17' ' ' LEU . 74.6 mt -61.64 -51.42 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.04 -0.527 . . . . 75.5 111.623 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -52.13 -50.05 62.47 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.05 0.452 . . . . 64.42 111.733 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.878 HH12 ' HB2' ' A' ' 28' ' ' LYS . 66.7 mtt-85 -62.78 -42.02 99.51 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.859 -0.337 . . . . 70.23 111.657 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -57.6 -44.08 85.16 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.38 . . . . 73.55 111.613 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.467 HD21 ' HB3' ' A' ' 122' ' ' ALA . 10.2 mp -56.84 -44.38 82.04 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.965 0.412 . . . . 72.22 110.571 174.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -66.52 -32.72 74.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.319 -0.4 . . . . 75.35 111.996 175.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 8.6 mm-40 -62.35 -41.99 99.04 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.354 0.597 . . . . 74.23 110.645 177.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -78.46 -30.67 47.53 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.636 -0.711 . . . . 73.5 112.207 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.32 -38.69 71.7 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.937 0.398 . . . . 74.43 111.739 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 63.6 p -87.05 -36.21 18.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.766 0.317 . . . . 74.22 111.715 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.63 19.74 65.37 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.06 -0.591 . . . . 71.14 111.966 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -124.16 -163.89 1.19 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.562 0.345 . . . . 64.04 111.293 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.437 ' HD2' ' O ' ' A' ' 26' ' ' ASP . 0.0 OUTLIER -120.65 151.52 39.38 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.962 0.411 . . . . 61.51 111.372 175.755 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.437 ' O ' ' HD2' ' A' ' 25' ' ' LYS . 29.5 t70 -67.27 154.38 41.44 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.45 0.643 . . . . 75.1 112.601 -177.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 t -140.05 25.83 2.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.97 -0.559 . . . . 65.02 111.803 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.878 ' HB2' HH12 ' A' ' 15' ' ' ARG . 21.5 mtpp -128.52 164.14 40.06 Favored Pre-proline 0 CA--C 1.545 0.782 0 O-C-N 122.116 -0.365 . . . . 53.52 111.697 -173.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 28' ' ' LYS . 29.8 Cg_endo -63.88 112.44 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.456 2.104 . . . . 71.42 112.613 178.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.416 ' HE3' ' HD2' ' A' ' 15' ' ' ARG . 57.1 mtp -83.74 -166.9 1.52 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.433 0.901 . . . . 53.11 113.433 -172.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.576 ' HA2' ' HG3' ' A' ' 11' ' ' GLU . . . -38.07 145.42 0.16 Allowed Glycine 0 C--N 1.341 0.814 0 N-CA-C 116.114 1.206 . . . . 64.15 116.114 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -54.2 -25.36 22.38 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.154 0.982 . . . . 74.32 113.619 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.504 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 26.6 m -78.83 0.0 28.83 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.457 0.54 . . . . 75.54 112.457 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.48 -119.58 10.41 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 121.324 -0.465 . . . . 73.21 113.953 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -51.09 -42.55 60.68 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.62 0.6 . . . . 74.14 112.62 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.5 m -54.86 -36.89 65.56 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.257 0.465 . . . . 64.25 112.257 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.3 p -69.77 -38.82 76.87 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.789 0.328 . . . . 74.43 110.81 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -61.62 -55.08 34.55 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.895 0.378 . . . . 73.42 111.365 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 20.6 mtpp -55.09 -45.18 75.41 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.001 -0.545 . . . . 73.41 110.875 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB1' HD11 ' A' ' 12' ' ' ILE . . . -60.48 -44.59 95.76 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.312 -0.404 . . . . 74.32 111.547 176.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.2 -54.46 40.63 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.336 0.495 . . . . 71.42 112.336 -177.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.47 -22.37 63.64 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.995 -0.441 . . . . 63.21 111.864 -177.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.502 HG21 HG23 ' A' ' 152' ' ' VAL . 61.3 m -73.5 -40.44 64.07 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 122.233 -0.292 . . . . 75.51 110.526 171.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 40' ' ' ALA . 42.3 mt -55.37 -42.34 73.79 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.058 0.392 . . . . 64.0 112.058 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.489 ' NH2' ' HB3' ' A' ' 19' ' ' GLU . 1.1 ptp85 -74.16 -36.05 64.06 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.007 -0.433 . . . . 74.23 111.865 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -63.41 -44.62 94.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.777 0.322 . . . . 73.33 111.664 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.471 ' O ' HG23 ' A' ' 51' ' ' VAL . 25.6 m -87.85 -33.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.813 0.339 . . . . 64.45 111.699 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.97 -29.97 72.35 Favored Glycine 0 CA--C 1.523 0.587 0 CA-C-N 116.308 -0.406 . . . . 63.11 113.265 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.564 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 12.3 t70 -51.19 -58.02 7.25 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.955 0.407 . . . . 74.13 110.968 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.02 -45.37 95.72 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.052 -0.594 . . . . 73.23 113.038 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 47' ' ' VAL . 95.0 t -56.8 -44.86 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 122.493 -0.416 . . . . 72.11 111.742 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 48.7 mt-30 -64.73 -38.65 91.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.855 0.317 . . . . 74.52 111.855 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 79.6 mtt-85 -61.67 -37.93 85.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.114 -0.366 . . . . 73.42 111.756 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -77.15 -46.0 24.88 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.006 0.431 . . . . 74.24 111.48 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -76.78 -21.21 55.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.033 0.753 . . . . 75.32 113.033 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -50.4 -55.01 17.62 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 112.265 0.469 . . . . 74.11 112.265 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -57.34 -27.69 62.46 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 120.867 0.365 . . . . 75.15 111.85 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.54 -47.15 13.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.454 -0.339 . . . . 72.25 111.724 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.92 -30.97 70.52 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.015 0.376 . . . . 74.22 112.015 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -52.21 -36.84 53.25 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.835 0.35 . . . . 75.11 111.195 174.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.68 -29.56 64.4 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.082 -0.508 . . . . 41.3 113.167 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.457 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 63.2 mtm -90.62 -43.88 9.89 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 122.412 -0.463 . . . . 75.55 111.658 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.403 HD11 HG23 ' A' ' 105' ' ' VAL . 8.2 mp -58.87 -32.98 69.97 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.348 0.499 . . . . 75.03 112.348 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -60.96 -12.61 11.89 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.645 0.609 . . . . 74.11 112.645 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.21 5.98 9.15 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.522 0.564 . . . . 72.11 112.522 179.089 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 62' ' ' MET . 79.3 mt -88.73 -83.47 0.22 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.319 0.489 . . . . 72.14 112.319 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 49.56 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.488 0.661 . . . . 63.34 112.529 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.521 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -82.37 120.4 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.692 -0.686 . . . . 54.14 111.239 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.43 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -104.2 -14.39 15.86 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.234 0.457 . . . . 72.22 112.234 178.718 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.43 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -164.93 178.72 6.92 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.308 0.575 . . . . 74.41 112.282 173.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -48.8 -40.48 29.29 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.288 0.847 . . . . 73.12 113.288 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -58.31 -35.41 71.8 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 111.769 0.285 . . . . 74.2 111.769 -175.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.521 ' HB2' HG23 ' A' ' 68' ' ' ILE . 25.3 m-20 -67.8 -41.38 83.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.249 0.547 . . . . 65.13 110.627 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 87.8 t -56.01 -42.95 73.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 115.892 -0.595 . . . . 73.22 111.019 177.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.04 -31.47 72.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.912 -0.586 . . . . 74.43 111.525 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 t -64.86 -37.49 87.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.13 0.49 . . . . 74.23 110.675 176.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt -59.83 -31.94 70.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.231 -0.441 . . . . 73.41 111.268 176.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.2 t -57.8 -36.77 72.67 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.109 0.48 . . . . 61.2 111.173 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -64.3 -40.98 97.04 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.267 -0.424 . . . . 73.13 110.656 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.01 -43.89 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 120.947 0.403 . . . . 71.41 110.527 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.456 ' HB2' HG22 ' A' ' 128' ' ' VAL . 20.0 mmt -55.49 -38.67 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.201 0.524 . . . . 61.12 111.233 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 74.6 mt -61.06 -41.56 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.024 -0.535 . . . . 74.41 111.18 175.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -66.05 -28.55 68.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.511 -0.313 . . . . 74.04 111.533 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 86.8 t -61.65 -35.65 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 111.777 0.288 . . . . 71.22 111.777 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.561 ' CZ ' HD23 ' A' ' 98' ' ' LEU . 20.7 m-85 -91.6 28.69 1.67 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.414 0.524 . . . . 75.23 112.414 179.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.0 t -58.25 -36.77 73.72 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.572 0.582 . . . . 73.25 112.572 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -87.16 170.18 11.71 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.181 0.515 . . . . 63.45 112.115 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -113.29 -1.49 24.93 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.186 -0.461 . . . . 54.02 113.638 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.47 HG21 ' HD2' ' A' ' 94' ' ' ARG . 24.9 m -60.04 138.11 21.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-N 117.219 0.509 . . . . 74.23 111.97 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 51.2 p -84.94 35.62 0.58 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.596 0.591 . . . . 72.12 112.596 -172.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.53 108.45 17.31 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.119 -0.363 . . . . 71.43 111.227 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.468 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.7 m95 -57.35 -19.58 23.65 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.403 0.52 . . . . 72.2 112.403 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.73 -25.99 45.46 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.993 -0.622 . . . . 38.55 112.654 174.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.47 ' HD2' HG21 ' A' ' 89' ' ' VAL . 71.0 mtp180 -67.24 -40.22 86.3 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.064 0.459 . . . . 74.05 110.531 175.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 40.4 mm -63.7 -43.31 98.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 116.074 -0.512 . . . . 75.0 110.062 174.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.8 t -58.85 -42.42 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.894 -0.594 . . . . 71.32 110.568 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.2 m -58.66 -43.77 89.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.938 0.399 . . . . 75.42 111.278 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.561 HD23 ' CZ ' ' A' ' 85' ' ' PHE . 32.5 tp -61.46 -55.11 34.83 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.243 0.544 . . . . 63.44 111.593 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.0 mt -66.84 -40.68 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 116.13 -0.486 . . . . 55.53 111.717 -176.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 99.9 p -64.32 -44.05 92.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.63 -0.259 . . . . 64.31 111.172 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.424 ' CD2' ' HE2' ' A' ' 81' ' ' MET . 32.6 t80 -60.8 -42.27 97.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.595 0.236 . . . . 74.23 110.994 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.66 90.41 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 120.727 -0.749 . . . . 65.24 112.193 174.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.79 -29.53 69.5 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.105 0.478 . . . . 73.13 111.597 176.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -68.17 -47.26 68.47 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.256 -0.429 . . . . 74.34 110.647 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.403 HG23 HD11 ' A' ' 63' ' ' LEU . 53.8 t -64.89 -35.9 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.428 -0.351 . . . . 63.11 110.43 175.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.87 -43.12 69.31 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.176 -0.466 . . . . 71.01 111.453 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.429 ' NZ ' ' OE1' ' A' ' 52' ' ' GLN . 52.7 mttp -57.09 -45.92 82.97 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.265 0.555 . . . . 74.12 110.721 174.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 78.4 t60 -64.04 -33.63 76.17 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.938 -0.574 . . . . 74.12 111.307 178.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.34 -49.92 67.55 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.567 -0.288 . . . . 73.32 111.108 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -58.08 -38.42 76.37 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.981 0.419 . . . . 72.33 110.796 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.2 m -57.54 -35.04 69.78 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.055 -0.52 . . . . 71.44 111.531 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 31.9 pt -106.32 31.86 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 120.96 0.41 . . . . 71.55 111.149 176.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.8 p30 48.94 21.73 0.49 Allowed 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.959 1.096 . . . . 75.24 113.959 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -90.62 35.88 0.89 Allowed 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.998 -0.439 . . . . 65.04 111.371 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -44.91 69.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.9 0.333 . . . . 71.25 111.9 -177.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.4 m -57.28 -27.89 62.52 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.075 0.398 . . . . 73.12 112.075 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.6 m -65.41 -25.82 67.71 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.882 0.373 . . . . 71.11 111.835 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -53.95 -40.76 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.628 0.603 . . . . 75.41 112.628 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.57 -52.56 26.48 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.379 0.511 . . . . 73.31 112.379 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -59.15 -24.97 76.27 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 121.704 1.602 . . . . 63.44 112.308 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.58 -46.64 68.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.69 -0.485 . . . . 70.04 109.69 173.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.467 ' HB3' HD21 ' A' ' 17' ' ' LEU . . . -58.6 -39.21 79.75 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.291 -0.413 . . . . 72.51 111.174 174.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -57.33 -44.92 84.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.38 -0.373 . . . . 74.44 110.706 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 58.8 m -62.37 -45.13 94.56 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.373 -0.376 . . . . 73.24 111.572 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.414 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.9 mm -54.11 -53.35 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-O 121.44 0.638 . . . . 63.23 110.836 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 41.1 m -67.4 -36.39 81.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.521 -0.763 . . . . 71.51 111.704 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.7 t70 -59.93 -51.45 69.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.801 0.334 . . . . 43.3 110.598 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.456 HG22 ' HB2' ' A' ' 81' ' ' MET . 57.8 t -64.95 -41.87 93.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.049 0.452 . . . . 73.45 111.122 177.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.505 ' HG ' HD12 ' A' ' 137' ' ' LEU . 52.3 tp -54.41 -53.14 58.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.067 -0.515 . . . . 62.54 111.462 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.49 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 94.9 t -73.52 -33.1 38.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.187 -0.46 . . . . 74.35 111.415 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 24.9 tpt180 -48.58 -46.71 39.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.842 0.457 . . . . 74.12 111.917 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.553 HG22 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -114.13 -28.56 7.27 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.739 1.014 . . . . 64.34 113.739 -175.807 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.553 ' HD2' HG22 ' A' ' 132' ' ' THR . 3.5 mptp? -109.5 20.46 18.16 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.409 0.892 . . . . 64.13 113.409 -177.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 18.7 ttt180 -52.8 -53.91 41.6 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.261 0.467 . . . . 70.33 112.261 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -68.27 -40.0 82.01 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 111.866 0.321 . . . . 72.03 111.866 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -60.54 -41.39 94.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.631 0.253 . . . . 73.52 111.601 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.505 HD12 ' HG ' ' A' ' 129' ' ' LEU . 40.0 mt -54.84 -55.5 29.68 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.554 -0.294 . . . . 72.1 111.756 178.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -68.85 -41.12 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 112.218 0.451 . . . . 74.33 112.218 -178.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 66.5 mmtt -64.4 -39.36 93.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.52 0.563 . . . . 63.43 112.52 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -98.26 8.31 45.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.939 0.4 . . . . 74.52 111.411 178.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 60.41 22.73 12.3 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.012 -0.54 . . . . 70.35 112.184 178.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . 0.468 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 20.82 -82.23 0.0 OUTLIER Glycine 0 C--N 1.34 0.8 0 N-CA-C 116.177 1.231 . . . . 72.2 116.177 176.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.406 ' O ' HG22 ' A' ' 147' ' ' VAL . 37.4 m95 -74.87 -41.8 59.12 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.815 0.302 . . . . 71.43 111.815 -172.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -62.66 -46.21 89.27 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.468 . . . . 73.22 110.08 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.99 -31.1 77.07 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.969 -0.559 . . . . 73.52 112.537 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -59.55 -51.74 68.56 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.099 0.559 . . . . 74.02 110.976 176.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 143' ' ' TRP . 59.6 t -59.65 -39.24 79.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 115.813 -0.631 . . . . 74.3 111.514 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' GLU . . . . . 0.622 ' HB3' ' HA2' ' A' ' 157' ' ' GLY . 52.6 mt-10 -73.49 -35.66 65.69 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.238 0.459 . . . . 73.12 112.238 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -62.86 -49.04 76.45 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.925 0.393 . . . . 65.45 111.473 -177.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -82.95 -16.15 48.48 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.452 -0.34 . . . . 73.01 111.237 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 83.1 t60 61.33 78.76 0.27 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.493 0.664 . . . . 72.43 112.017 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.502 HG23 HG21 ' A' ' 43' ' ' THR . 69.3 t -118.45 -72.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 115.888 -0.596 . . . . 73.35 111.737 -178.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.402 ' O ' ' NZ ' ' A' ' 39' ' ' LYS . 0.4 OUTLIER -115.26 26.77 9.84 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.392 0.615 . . . . 73.41 110.356 -176.184 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -88.17 166.39 14.41 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 74.12 111.86 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . 0.465 HD12 ' HG2' ' A' ' 156' ' ' GLU . 0.0 OUTLIER -110.77 -10.32 14.46 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.066 0.395 . . . . 74.31 112.066 177.556 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . 0.465 ' HG2' HD12 ' A' ' 155' ' ' LEU . 12.0 pt-20 -134.32 -58.31 0.84 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.375 0.509 . . . . 73.2 112.375 -177.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' GLY . . . . . 0.622 ' HA2' ' HB3' ' A' ' 148' ' ' GLU . . . 54.5 -117.93 8.67 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 121.24 -0.505 . . . . 75.41 113.717 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.58 164.7 31.81 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.438 -0.411 . . . . 51.12 113.311 179.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -145.08 169.11 18.77 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 122.638 -0.331 . . . . 73.41 110.565 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 60.4 t60 70.62 21.17 5.49 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.116 0.484 . . . . 75.53 111.428 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.32 -32.51 74.14 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.296 0.57 . . . . 72.44 110.216 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 52.5 m-70 -117.22 109.55 17.03 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.753 -0.658 . . . . 73.34 110.09 171.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -61.77 120.59 10.98 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.599 0.592 . . . . 72.33 112.599 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.844 -0.598 . . . . 73.41 110.609 172.448 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 120.589 0.233 . . . . 71.14 110.394 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -57.28 -45.83 83.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.3 0.571 . . . . 63.42 110.843 175.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 69.5 tp -59.84 -38.88 83.32 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.716 -0.675 . . . . 71.42 111.089 175.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.25 -44.55 91.46 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.112 -0.494 . . . . 63.12 110.941 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mmm180 -63.49 -43.62 96.73 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.004 0.372 . . . . 74.33 112.004 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.43 ' O ' HG13 ' A' ' 12' ' ' ILE . 50.5 tt0 -60.62 -52.36 65.48 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.906 0.384 . . . . 75.32 111.35 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 p -61.6 -44.3 97.26 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.316 -0.402 . . . . 72.41 111.2 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.0 tp -54.83 -44.89 74.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.082 -0.508 . . . . 73.44 111.62 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 9.9 tp10 -61.95 -49.85 74.48 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.797 0.332 . . . . 74.5 111.166 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 8' ' ' GLN . 66.6 mt -54.84 -52.68 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.228 0.537 . . . . 74.43 111.106 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 99' ' ' ILE . 81.5 mt -64.78 -41.42 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.723 -0.671 . . . . 74.41 111.392 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -56.49 -46.29 80.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.339 -0.391 . . . . 63.42 111.418 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 62.5 mtp180 -61.89 -53.89 49.52 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.455 -0.339 . . . . 75.12 111.159 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.65 -42.02 67.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.821 0.343 . . . . 75.44 111.859 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.486 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.5 mp -65.69 -42.53 91.13 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.973 0.36 . . . . 71.12 111.973 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -66.84 -40.16 87.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 122.2 -0.312 . . . . 71.31 111.594 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 45.6 mt-10 -61.73 -50.61 71.71 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.108 0.48 . . . . 51.34 111.026 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.431 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 27.3 mm-40 -59.66 -40.01 86.33 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.206 -0.452 . . . . 64.12 111.714 176.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -64.62 -42.55 95.43 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.035 0.445 . . . . 74.02 111.847 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' HE2' ' A' ' 110' ' ' LYS . 69.4 p -87.49 -7.25 57.84 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.253 -0.43 . . . . 71.14 112.039 -176.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 C-N-CA 121.193 -0.527 . . . . 72.43 113.379 178.534 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.919 0 N-CA-C 114.28 0.472 . . . . 71.22 114.28 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.04 -49.95 14.19 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 122.615 -0.344 . . . . 72.21 111.855 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.8 m -55.15 -48.27 73.95 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.152 0.427 . . . . 65.32 112.152 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 m -68.01 -34.67 76.95 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.701 0.286 . . . . 73.2 111.503 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -63.58 -54.92 28.45 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.733 0.301 . . . . 61.34 111.449 176.314 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 18.5 ptmt -63.39 -36.85 85.1 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.844 0.355 . . . . 72.33 111.144 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.464 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -62.99 -46.79 86.04 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.656 0.265 . . . . 63.23 111.424 176.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.3 tp -61.06 -50.65 72.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.255 0.465 . . . . 74.52 112.255 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.8 pt-20 -64.8 -35.89 82.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 122.136 -0.353 . . . . 65.25 111.675 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.591 ' O ' HG22 ' A' ' 47' ' ' VAL . 53.6 m -65.96 -47.32 75.02 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.713 0.292 . . . . 72.14 110.695 174.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.3 mt -53.95 -49.43 68.73 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.229 0.455 . . . . 72.42 112.229 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 45' ' ' ARG . 10.7 ptm180 -66.43 -41.62 88.92 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.116 0.413 . . . . 65.01 112.116 -176.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -70.32 -42.99 71.23 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.152 0.427 . . . . 73.23 112.152 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 43' ' ' THR . 25.4 m -82.78 -33.48 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 122.035 -0.416 . . . . 74.33 111.427 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -62.11 -40.8 99.42 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.453 -0.403 . . . . 63.31 112.675 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 17.4 t70 -55.82 -47.69 76.75 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.971 0.415 . . . . 53.33 110.921 174.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.05 -44.21 96.44 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.972 -0.632 . . . . 75.21 112.63 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.5 t -57.89 -44.36 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-O 120.742 0.306 . . . . 74.31 111.063 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 76.8 mt-30 -60.33 -42.65 96.09 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.598 -0.273 . . . . 65.51 111.373 176.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.1 mmm180 -55.2 -52.66 62.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 111.975 0.361 . . . . 74.42 111.975 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -75.33 -33.21 61.11 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.16 0.43 . . . . 71.22 112.16 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -90.91 -17.62 26.13 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.765 1.024 . . . . 74.13 113.765 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -48.72 -50.25 34.39 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 118.163 0.438 . . . . 74.34 112.163 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.2 t -55.92 -31.09 62.59 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.046 0.388 . . . . 71.32 112.046 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.63 -48.61 11.52 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.38 -0.373 . . . . 52.25 111.692 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -58.55 -47.12 85.3 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.487 -0.324 . . . . 72.44 111.703 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -52.38 -30.4 28.81 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.877 0.37 . . . . 75.34 111.758 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.16 -39.99 95.16 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.285 -0.483 . . . . 51.22 113.017 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.0 mtm -90.6 -34.71 15.37 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.269 0.557 . . . . 71.42 110.575 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -58.56 -36.87 74.6 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.955 -0.566 . . . . 71.12 111.596 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -60.11 -39.43 86.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.222 -0.445 . . . . 71.43 111.849 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 -9.78 43.03 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 111.814 0.301 . . . . 75.43 111.814 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.1 mt -82.2 -76.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.656 0.265 . . . . 75.35 110.61 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 47.21 91.89 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.527 0.731 . . . . 74.51 112.321 -178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -76.68 110.12 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.243 0.545 . . . . 70.31 112.019 -175.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.16 -6.92 22.68 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.037 -0.528 . . . . 75.14 112.094 178.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -165.12 169.73 15.82 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.748 0.309 . . . . 73.04 111.521 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -54.31 -32.09 55.65 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.546 0.573 . . . . 63.22 112.546 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.35 -35.14 67.3 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.869 0.366 . . . . 73.04 111.729 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.3 m-20 -68.92 -35.52 76.92 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.02 0.438 . . . . 70.02 110.454 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.84 -41.1 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.218 0.532 . . . . 54.2 110.519 175.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -59.07 -32.16 69.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.034 -0.53 . . . . 64.11 110.856 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -72.13 -40.26 68.23 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.144 -0.48 . . . . 64.1 110.801 174.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.1 mt -56.49 -33.68 66.21 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.558 -0.292 . . . . 74.1 111.007 176.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.432 ' O ' HG13 ' A' ' 82' ' ' ILE . 28.8 t -51.75 -42.18 62.14 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.299 -0.41 . . . . 74.53 111.494 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.93 -43.04 99.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.896 0.379 . . . . 72.5 111.063 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 84' ' ' VAL . 79.8 t -63.52 -44.19 98.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 120.948 0.404 . . . . 65.25 110.745 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -55.73 -39.23 70.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.975 -0.557 . . . . 75.22 111.625 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 78' ' ' SER . 76.5 mt -62.11 -44.36 98.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-O 121.175 0.512 . . . . 71.15 111.165 175.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -65.0 -27.9 69.14 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.395 -0.366 . . . . 60.15 111.955 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 80' ' ' VAL . 66.8 t -58.66 -20.99 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.807 0.337 . . . . 61.12 111.672 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 37.7 m-85 . . . . . 0 N--CA 1.472 0.635 0 N-CA-C 112.352 0.501 . . . . 74.03 112.352 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.472 ' CE3' HG13 ' A' ' 95' ' ' ILE . 96.8 m95 . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 120.837 0.351 . . . . 72.33 111.234 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.03 -28.5 61.11 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 121.244 -0.503 . . . . 72.02 112.893 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -70.17 -34.53 73.1 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.547 -0.384 . . . . 72.32 111.173 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.472 HG13 ' CE3' ' A' ' 92' ' ' TRP . 29.0 mm -58.13 -45.98 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.601 0.715 . . . . 74.55 109.437 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.76 -44.72 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 115.248 -0.887 . . . . 64.55 111.085 174.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.5 m -61.43 -35.71 78.32 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.292 -0.413 . . . . 62.33 111.344 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.502 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 22.8 tp -62.77 -55.31 27.68 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.34 0.59 . . . . 72.14 110.952 176.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 56.3 mt -67.11 -35.24 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.862 -0.608 . . . . 44.21 111.377 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.0 t -65.52 -47.08 77.17 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.004 -0.544 . . . . 53.25 111.19 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.3 t80 -62.99 -39.82 95.92 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.748 0.308 . . . . 63.24 110.593 176.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.7 -46.13 89.73 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.856 -0.688 . . . . 65.42 112.274 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.878 0.37 . . . . 74.31 111.547 176.334 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.13 -39.34 94.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.978 0.418 . . . . 75.44 111.017 178.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 101' ' ' PHE . 40.6 t -75.09 -38.97 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 120.941 0.4 . . . . 70.34 110.64 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.76 82.87 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.42 0.526 . . . . 75.11 112.42 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 18.3 ptpt -62.46 -34.89 77.71 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.76 0.314 . . . . 63.4 111.006 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.425 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -65.72 -37.69 87.11 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.853 0.358 . . . . 71.04 110.505 173.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.533 HD21 ' HB ' ' A' ' 68' ' ' ILE . 87.6 mt -61.78 -50.28 72.97 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.367 -0.379 . . . . 75.23 111.609 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 66.4 tttp -63.02 -35.64 80.91 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.994 -0.441 . . . . 74.22 110.79 177.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 85.0 m -56.19 -41.67 75.91 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.928 0.394 . . . . 74.5 110.846 175.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.5 pt -97.97 20.4 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 112.08 0.4 . . . . 74.33 112.08 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 71.78 3.45 4.67 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.561 0.948 . . . . 72.52 113.561 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -84.82 45.55 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.601 0.593 . . . . 61.24 112.601 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.58 -34.25 76.6 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.117 0.414 . . . . 74.22 112.117 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.4 m -58.88 -26.52 64.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.821 0.343 . . . . 73.2 111.49 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -77.83 -27.52 49.96 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.551 -0.295 . . . . 72.4 111.714 178.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.7 mt -57.68 -46.27 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.622 0.601 . . . . 63.54 112.622 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.84 -52.05 44.11 Favored Pre-proline 0 CA--C 1.55 0.943 0 N-CA-C 112.577 0.584 . . . . 74.2 112.577 -174.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.15 -27.45 84.91 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.802 1.668 . . . . 74.43 112.134 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -64.71 -48.0 76.26 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.711 -0.477 . . . . 72.22 109.711 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.486 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.04 -39.97 72.8 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.001 0.429 . . . . 72.32 111.031 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.09 -36.89 85.51 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.214 -0.448 . . . . 73.11 111.061 174.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -64.42 -43.18 95.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 120.79 0.329 . . . . 74.34 111.209 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.3 mm -56.52 -52.92 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.27 0.557 . . . . 71.3 110.57 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 m -64.54 -35.17 80.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.76 -0.654 . . . . 65.23 111.39 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 13.7 t70 -60.33 -52.74 63.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.37 -0.377 . . . . 74.2 111.197 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.472 ' O ' HG22 ' A' ' 132' ' ' THR . 66.5 t -64.27 -42.04 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 121.027 0.441 . . . . 62.12 110.791 177.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.1 tp -54.27 -52.87 60.03 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.866 -0.607 . . . . 74.34 111.257 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 85.0 t -74.85 -23.85 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 115.958 -0.564 . . . . 74.32 111.85 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 48.7 ttm-85 -70.17 -46.79 63.91 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.092 0.404 . . . . 73.53 112.092 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 133' ' ' LYS . 8.0 t -108.26 -34.99 6.66 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.373 0.879 . . . . 75.3 113.373 -176.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HG2' HG23 ' A' ' 132' ' ' THR . 75.5 mmtt -99.39 18.66 17.18 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.938 -0.477 . . . . 75.21 112.017 -177.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 9.0 tpt180 -46.32 -61.71 1.67 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.101 0.56 . . . . 45.15 112.481 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -62.48 -41.41 98.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.927 -0.578 . . . . 73.14 111.985 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -59.55 -38.31 80.74 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.797 0.332 . . . . 54.14 111.509 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.7 mt -56.62 -51.15 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.395 -0.366 . . . . 73.33 111.919 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.7 p -78.16 -43.6 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 63.41 112.383 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -61.13 -50.5 72.97 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.216 0.451 . . . . 70.1 112.216 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -94.08 9.84 36.09 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.014 0.435 . . . . 74.04 111.057 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 143' ' ' TRP . 48.0 mtm180 58.89 25.58 13.84 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.74 -0.664 . . . . 75.11 111.745 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 24.53 -79.78 0.0 OUTLIER Glycine 0 N--CA 1.471 1.013 0 N-CA-C 115.562 0.985 . . . . 61.24 115.562 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 40' ' ' ALA . 31.4 m95 -70.83 -46.08 63.38 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.805 0.336 . . . . 70.34 111.678 -176.066 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 11.3 m-20 -61.78 -40.49 95.37 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.2 0.524 . . . . 74.23 110.218 175.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.99 -31.17 67.06 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.847 -0.615 . . . . 62.42 112.705 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -63.54 -46.37 86.31 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.108 0.563 . . . . 71.33 111.613 178.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.583 HG13 ' HB ' ' A' ' 152' ' ' VAL . 96.7 t -67.44 -36.26 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 112.33 0.493 . . . . 53.34 112.33 -178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.01 -38.04 64.21 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 122.204 -0.31 . . . . 71.34 111.157 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.96 -48.14 83.2 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.824 0.345 . . . . 73.42 111.453 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -82.5 -1.59 50.9 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.058 0.392 . . . . 72.5 112.058 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.2 t60 56.65 72.48 0.5 Allowed 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.47 0.545 . . . . 73.51 112.47 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 147' ' ' VAL . 97.6 t . . . . . 0 N--CA 1.471 0.587 0 O-C-N 122.256 -0.278 . . . . 71.34 110.866 174.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 m-20 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 120.897 0.38 . . . . 73.42 111.597 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.21 -30.82 71.75 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.495 0.664 . . . . 63.53 109.262 171.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 137' ' ' LEU . 57.0 tp -55.37 -43.82 75.48 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.454 -0.794 . . . . 73.11 110.669 170.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 58.8 t80 -60.54 -47.51 85.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.541 -0.754 . . . . 74.12 111.314 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -71.36 -31.34 67.22 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.077 0.399 . . . . 72.53 112.077 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 41.0 tt0 -65.61 -53.34 43.03 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.169 0.509 . . . . 64.34 110.58 175.207 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 p -61.08 -42.47 98.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.808 -0.633 . . . . 53.22 110.961 178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 tp -55.33 -47.69 75.29 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.022 -0.536 . . . . 74.33 112.047 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.94 -41.46 91.29 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.798 0.332 . . . . 74.43 111.082 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLN . 81.6 mt -59.04 -54.14 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.108 0.48 . . . . 74.25 111.074 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' LEU . 80.8 mt -61.76 -44.95 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.02 -0.537 . . . . 74.24 111.235 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.3 t -54.83 -46.6 74.63 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.772 0.32 . . . . 71.42 111.365 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.549 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 9.9 mtp180 -57.96 -58.02 10.26 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.698 0.285 . . . . 64.01 110.963 175.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.409 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 59.2 t80 -53.68 -44.72 69.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.029 -0.532 . . . . 75.52 111.991 -174.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.0 mp -59.95 -45.98 90.91 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.539 -0.3 . . . . 74.51 111.556 177.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.447 ' HG3' HH11 ' A' ' 18' ' ' ARG . 39.5 mmm-85 -65.91 -43.88 86.87 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.777 0.323 . . . . 73.41 111.399 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.549 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 42.1 mt-10 -63.26 -41.95 99.09 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.892 0.377 . . . . 44.15 111.489 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -71.43 -40.62 70.29 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.8 0.333 . . . . 73.23 111.735 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.92 97.6 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.963 0.411 . . . . 74.11 111.723 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.9 p -89.04 -16.16 32.31 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.259 0.466 . . . . 52.3 112.259 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.9 0 C-N-CA 120.957 -0.639 . . . . 72.51 112.465 -176.444 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.861 0 N-CA-C 114.286 0.475 . . . . 65.22 114.286 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.578 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -60.43 -50.83 72.03 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.063 0.394 . . . . 55.11 112.063 -176.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.3 m -58.82 -38.82 79.51 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.98 0.419 . . . . 74.31 111.477 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.8 p -73.24 -39.07 65.76 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.535 -0.302 . . . . 53.32 111.505 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -59.54 -54.58 44.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.808 0.337 . . . . 74.52 111.265 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 22.5 mtpp -55.33 -41.59 72.65 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.055 -0.521 . . . . 64.3 110.894 -177.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.23 82.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.237 -0.438 . . . . 45.2 111.465 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.04 -53.12 60.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.126 0.417 . . . . 73.02 112.126 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -66.51 -21.37 66.17 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.173 -0.33 . . . . 72.22 111.829 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 47' ' ' VAL . 97.4 m -77.5 -42.31 36.14 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.807 0.337 . . . . 54.24 110.265 170.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.25 -40.79 71.35 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.375 -0.375 . . . . 72.52 111.72 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.409 ' HA ' ' HE1' ' A' ' 16' ' ' TYR . 5.7 ptm180 -72.65 -37.63 67.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.055 -0.403 . . . . 64.21 111.231 178.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -66.91 -44.89 79.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.993 0.425 . . . . 63.23 111.68 -178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 51' ' ' VAL . 18.7 m -90.94 -33.65 5.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 120.891 0.377 . . . . 75.21 111.533 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.25 -47.16 83.23 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 116.076 -0.511 . . . . 71.41 113.902 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 13.7 t70 -51.71 -53.31 40.67 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 117.472 0.636 . . . . 62.1 110.621 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.88 -46.48 90.49 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.994 -0.548 . . . . 64.41 113.112 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.0 t -57.62 -42.21 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 O-C-N 122.786 -0.244 . . . . 71.35 111.033 177.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.3 mt-30 -59.32 -53.39 58.78 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.586 -0.279 . . . . 73.12 110.982 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 9.0 mmm180 -58.33 -41.24 84.16 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.738 0.304 . . . . 73.1 111.756 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -71.42 -46.05 61.12 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.289 0.566 . . . . 72.13 111.685 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -80.16 -17.53 52.19 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.858 -0.61 . . . . 74.51 112.479 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 38.0 tt0 -48.18 -54.82 12.1 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.863 0.69 . . . . 73.44 112.863 -172.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.97 -31.55 67.0 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.902 0.382 . . . . 73.43 111.843 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.7 -36.24 60.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.842 0.353 . . . . 75.05 111.542 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -76.06 -31.76 58.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.947 0.351 . . . . 72.23 111.947 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -48.35 -39.58 22.56 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.855 0.36 . . . . 70.31 111.776 178.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.46 -37.95 61.61 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 116.052 -0.522 . . . . 74.55 113.761 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.474 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 56.9 mtm -90.45 -38.96 12.92 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.119 -0.636 . . . . 64.13 110.506 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.5 tp -54.49 -43.85 72.13 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.871 -0.604 . . . . 65.12 111.868 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -57.22 -30.18 64.37 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.811 0.671 . . . . 63.23 112.811 -177.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' A' ' 62' ' ' MET . 19.0 pttp -101.26 4.82 42.12 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.866 0.365 . . . . 50.04 111.854 -177.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.4 mt -99.94 -69.57 0.76 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.704 0.288 . . . . 75.51 110.868 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 71.7 -48.63 0.68 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.479 0.918 . . . . 72.52 113.479 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.442 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.6 mp 62.97 98.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.571 0.7 . . . . 74.25 111.476 -174.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -102.15 -9.56 20.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.863 -179.332 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -163.12 177.55 9.01 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.459 0.541 . . . . 62.32 112.459 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.58 -41.85 54.93 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.847 0.684 . . . . 74.44 112.847 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.78 -39.38 68.33 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.659 0.266 . . . . 63.11 111.309 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.92 -41.93 95.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.197 0.523 . . . . 74.14 110.836 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.8 t -57.59 -48.06 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.26 0.552 . . . . 61.44 110.939 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.7 -26.24 65.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.311 -0.404 . . . . 74.15 111.321 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.0 t -65.73 -39.34 91.04 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.064 0.459 . . . . 52.21 110.682 172.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 81' ' ' MET . 92.0 mt -59.14 -35.44 73.49 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.266 -0.425 . . . . 75.35 111.075 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.437 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.2 t -52.58 -40.43 62.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.916 0.388 . . . . 71.45 111.383 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -53.55 -35.97 61.33 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.287 -0.415 . . . . 72.12 111.46 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 58.2 t -82.72 -39.13 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.015 0.436 . . . . 75.12 111.183 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.454 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.4 mmt -54.37 -37.49 65.04 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.114 0.483 . . . . 71.41 111.366 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 78' ' ' SER . 74.7 mt -59.28 -40.03 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 116.22 -0.445 . . . . 42.32 111.518 175.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -66.62 -32.02 73.08 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 120.767 0.318 . . . . 74.34 111.474 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.3 t -57.39 -29.42 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-O 120.991 0.424 . . . . 74.24 111.542 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.463 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 25.2 m-85 . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.727 0.639 . . . . 71.24 112.727 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 92.4 m95 . . . . . 0 CA--C 1.538 0.497 0 CA-C-O 120.948 0.404 . . . . 74.11 111.411 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.86 -24.74 50.66 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.078 -0.582 . . . . 71.31 112.763 173.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -64.46 -39.08 93.13 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.641 -0.329 . . . . 74.23 110.767 174.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.9 mm -59.35 -48.68 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.336 0.589 . . . . 74.12 110.118 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.45 -46.88 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 115.541 -0.754 . . . . 61.05 110.988 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.5 m -59.26 -48.81 80.21 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.328 -0.396 . . . . 73.25 111.655 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.505 ' HG ' HG23 ' A' ' 125' ' ' ILE . 33.0 tp -56.59 -54.53 44.9 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.221 0.534 . . . . 71.12 111.485 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 53.5 mt -67.74 -32.99 59.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 116.018 -0.537 . . . . 73.22 111.148 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.2 t -60.48 -51.7 68.35 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.257 -0.429 . . . . 75.13 111.291 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 105' ' ' VAL . 28.4 t80 -64.42 -37.76 88.64 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.604 -0.271 . . . . 75.35 110.782 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -48.99 78.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.872 -0.68 . . . . 43.34 112.572 175.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.442 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.62 -35.99 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.109 0.481 . . . . 64.44 111.259 176.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.562 ' CE2' HD22 ' A' ' 63' ' ' LEU . 47.4 t80 -62.46 -44.2 96.98 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.045 -0.525 . . . . 64.42 111.115 178.036 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 101' ' ' PHE . 55.9 t -66.87 -37.53 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 120.824 0.345 . . . . 52.44 110.471 175.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.66 -38.54 72.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.237 -0.438 . . . . 61.34 111.655 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.6 -45.05 93.06 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.104 0.478 . . . . 74.04 110.734 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.45 ' O ' HG12 ' A' ' 112' ' ' ILE . 82.4 t60 -64.6 -39.95 94.63 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.212 -0.449 . . . . 71.03 110.704 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.23 -49.26 78.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.358 -0.383 . . . . 71.42 111.564 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -59.99 -44.13 94.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.095 0.474 . . . . 54.24 110.466 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.8 m -56.7 -45.09 82.04 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.113 -0.494 . . . . 75.34 111.706 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 108' ' ' HIS . 35.7 pt -87.15 12.66 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-O 120.92 0.391 . . . . 71.23 111.773 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 67.99 16.58 9.56 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.041 0.756 . . . . 61.3 113.041 174.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -92.74 38.86 1.03 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.83 0.348 . . . . 73.32 110.942 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.24 -32.95 67.08 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.083 0.401 . . . . 61.05 112.083 -176.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.5 p -56.26 -38.34 71.03 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.847 0.356 . . . . 74.55 111.704 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.5 m -61.96 -26.74 68.38 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.68 0.622 . . . . 75.43 112.68 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 18' ' ' ARG . 65.8 mt -54.5 -45.36 70.57 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 112.874 0.694 . . . . 74.32 112.874 -176.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.32 -52.71 35.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 112.44 0.533 . . . . 54.23 112.44 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -26.11 81.66 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.75 1.633 . . . . 52.22 112.262 173.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.6 tt -66.16 -44.39 84.22 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.635 -0.505 . . . . 75.21 109.635 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.3 -37.67 75.54 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.219 -0.446 . . . . 70.45 110.896 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.05 -39.3 94.32 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.562 -0.29 . . . . 62.32 111.414 174.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.7 m -63.15 -45.71 90.63 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.016 0.436 . . . . 70.04 110.986 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.6 mm -56.58 -52.78 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.297 0.57 . . . . 62.31 110.794 175.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.6 m -65.91 -34.81 78.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.804 -0.635 . . . . 72.3 111.974 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 20.3 t70 -63.14 -50.27 71.08 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.458 -0.337 . . . . 71.52 110.53 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.7 t -63.05 -39.82 86.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.053 0.454 . . . . 51.2 111.084 176.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.53 ' HG ' HD11 ' A' ' 137' ' ' LEU . 60.1 tp -53.28 -53.12 55.44 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.185 0.517 . . . . 70.21 111.338 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.514 ' HA ' ' HB3' ' A' ' 134' ' ' ARG . 42.0 t -73.6 -31.15 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 CA-C-N 116.038 -0.528 . . . . 43.34 111.756 177.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.7 tpt180 -52.54 -42.42 64.4 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.212 0.605 . . . . 61.41 112.389 -176.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.697 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.6 t -126.16 -21.67 4.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.723 1.009 . . . . 75.44 113.723 -175.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 132' ' ' THR . 32.5 mmtp -122.67 13.27 10.01 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.293 0.849 . . . . 73.42 113.293 -173.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 0.2 OUTLIER -60.26 -40.46 90.43 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.537 0.684 . . . . 73.33 110.913 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 134' ' ' ARG . 33.0 t70 -59.44 -50.63 73.2 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.146 -0.934 . . . . 53.44 110.803 177.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -59.05 -36.83 75.71 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.739 0.304 . . . . 64.23 111.549 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.53 HD11 ' HG ' ' A' ' 129' ' ' LEU . 88.1 mt -57.91 -49.33 77.1 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.436 -0.347 . . . . 73.11 111.791 176.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.8 p -77.6 -31.98 17.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 112.041 0.386 . . . . 55.1 112.041 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.4 mmtt -64.34 -58.58 6.09 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.08 0.466 . . . . 74.44 111.813 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -91.73 -1.32 57.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.089 0.403 . . . . 73.51 112.089 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 59.84 80.83 0.19 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.248 0.547 . . . . 65.43 110.242 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -55.31 -50.75 58.34 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.474 -0.784 . . . . 71.11 114.352 -171.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.44 ' O ' HG23 ' A' ' 147' ' ' VAL . 26.1 m95 -73.84 -36.27 64.89 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 117.014 0.407 . . . . 71.24 111.903 -175.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.22 -51.67 65.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.487 0.661 . . . . 61.43 110.741 174.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.07 -31.66 78.44 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.486 -0.779 . . . . 51.11 113.101 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.89 -45.21 82.71 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.118 0.485 . . . . 71.12 111.288 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 143' ' ' TRP . 48.2 t -65.61 -46.01 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.96 -0.564 . . . . 61.54 112.168 -178.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -27.73 61.24 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.101 0.408 . . . . 71.0 112.101 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -57.3 -49.1 77.19 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.215 0.531 . . . . 72.32 110.953 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -83.66 -0.3 50.09 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.263 -0.426 . . . . 71.43 111.472 173.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 19.3 t60 60.17 37.73 20.58 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.335 0.654 . . . . 73.15 112.055 175.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 120.873 0.368 . . . . 71.12 110.922 179.571 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 4.0 p30 . . . . . 0 CA--C 1.543 0.709 0 CA-C-O 120.745 0.307 . . . . 54.4 111.209 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.42 -46.08 91.28 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.385 0.513 . . . . 72.24 112.385 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.584 HD23 ' HG3' ' A' ' 134' ' ' ARG . 65.0 tp -61.28 -42.74 99.16 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.08 0.467 . . . . 73.45 110.628 -179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -56.42 -45.29 80.78 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.764 -0.653 . . . . 72.41 111.037 174.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 25.3 mmm180 -66.71 -48.47 69.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.127 0.417 . . . . 75.41 112.127 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.416 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.6 tt0 -62.1 -51.4 68.06 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.063 0.459 . . . . 73.34 110.964 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.2 p -57.13 -37.74 72.44 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.04 0.447 . . . . 75.33 110.627 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.567 HD11 ' HG2' ' A' ' 123' ' ' GLU . 44.1 tp -60.09 -46.04 90.93 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.919 -0.582 . . . . 62.44 111.993 178.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.9 pt-20 -67.09 -40.76 87.01 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 120.452 -0.499 . . . . 71.11 110.939 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.44 ' N ' ' HG3' ' A' ' 11' ' ' GLU . 66.3 mt -57.21 -53.6 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.158 0.504 . . . . 72.25 110.964 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.468 HG23 HG23 ' A' ' 99' ' ' ILE . 84.3 mt -66.91 -45.69 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 115.852 -0.613 . . . . 61.01 111.502 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 27.7 t -56.52 -53.94 51.66 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.406 -0.361 . . . . 71.44 111.416 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.643 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 40.3 mtt180 -55.95 -49.75 72.67 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.305 -0.257 . . . . 74.44 110.305 176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.477 ' CD2' HG22 ' A' ' 99' ' ' ILE . 62.7 t80 -52.54 -44.91 66.09 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.994 0.368 . . . . 71.51 111.994 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.561 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.8 mp -60.66 -40.83 93.51 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.371 -0.205 . . . . 74.43 111.21 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 31.3 mmm-85 -64.63 -42.41 95.51 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.952 0.406 . . . . 70.13 110.876 177.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 4.7 mm-40 -56.66 -49.94 73.55 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.594 0.712 . . . . 64.13 110.881 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -75.43 -30.8 60.15 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.702 -0.681 . . . . 73.12 112.463 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -38.14 73.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.021 0.439 . . . . 65.14 111.637 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.3 p -87.69 -36.97 17.1 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.233 -0.439 . . . . 73.32 111.231 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.924 0 CA-C-N 116.28 -0.418 . . . . 71.0 112.517 -176.915 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.588 0 N-CA-C 113.487 0.155 . . . . 74.43 113.487 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.582 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -74.84 -52.21 11.97 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.405 0.521 . . . . 52.52 112.405 -174.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.1 m -59.13 -51.34 70.45 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 120.947 0.403 . . . . 71.4 111.443 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.7 m -60.48 -32.69 71.66 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.337 -0.392 . . . . 70.22 111.65 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -69.14 -48.64 61.83 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.017 0.436 . . . . 73.11 110.881 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 26.3 mtpp -56.59 -48.37 77.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.427 0.632 . . . . 70.42 110.667 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.71 77.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.758 -0.655 . . . . 73.42 111.9 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -54.8 -52.84 61.38 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.297 0.48 . . . . 70.04 112.297 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.41 -42.25 98.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.671 0.272 . . . . 61.25 111.366 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.494 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -63.95 -35.45 80.74 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.755 -0.202 . . . . 64.02 111.484 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 41.6 mt -53.91 -52.11 61.59 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.625 0.25 . . . . 74.32 111.673 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -77.24 -29.36 53.99 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.198 -0.314 . . . . 74.42 111.758 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.41 ' NH1' HG11 ' A' ' 152' ' ' VAL . 42.2 ttm180 -61.54 -44.45 97.02 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.421 -0.354 . . . . 72.03 111.56 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 43' ' ' THR . 22.3 m -93.78 -33.27 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.143 0.497 . . . . 73.02 111.135 176.546 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -56.82 -59.48 10.75 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.706 -0.679 . . . . 53.33 113.271 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.553 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 24.6 t70 -53.12 -34.01 54.86 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 117.322 0.561 . . . . 53.44 111.406 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.3 -49.33 75.45 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.216 -0.516 . . . . 44.32 112.598 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.62 -37.07 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-O 120.817 0.341 . . . . 72.41 111.464 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 28.6 mt-30 -56.92 -52.1 66.49 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.398 -0.365 . . . . 75.3 111.263 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 34.6 mmm-85 -62.09 -27.95 69.28 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.987 0.365 . . . . 64.03 111.987 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-20 -72.05 -41.95 66.84 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.373 0.606 . . . . 74.12 110.763 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -85.19 -15.67 42.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.499 -0.773 . . . . 52.44 112.582 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 52' ' ' GLN . 43.3 tt0 -47.32 -44.98 24.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.305 0.642 . . . . 74.21 112.717 -170.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.6 t -55.55 -42.56 74.81 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.952 0.406 . . . . 62.13 111.737 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.86 -48.28 32.25 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.795 0.331 . . . . 51.01 111.794 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -57.49 -44.11 84.69 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.559 -0.291 . . . . 72.12 111.749 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -55.01 -39.65 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.121 0.486 . . . . 75.41 110.835 174.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -63.77 -28.74 73.07 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-N 116.055 -0.521 . . . . 55.01 112.787 176.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 82.7 mtp -79.09 -47.98 15.15 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.094 0.473 . . . . 74.21 110.687 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.63 -34.84 73.3 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.294 0.479 . . . . 72.41 112.294 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.0 ptt180 -67.79 -16.7 64.24 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 111.968 0.359 . . . . 62.41 111.968 -178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 11.27 22.49 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.087 0.47 . . . . 71.45 111.161 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 -73.66 0.64 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.026 -0.534 . . . . 63.53 111.221 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 70.45 -43.86 0.56 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 113.766 1.024 . . . . 73.12 113.766 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.451 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.5 mp 62.83 90.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.445 0.64 . . . . 64.15 111.026 -174.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -12.6 33.13 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.975 -0.557 . . . . 75.42 111.935 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.2 p-10 -159.23 175.28 13.61 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.359 0.599 . . . . 73.12 112.274 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.08 -35.26 69.17 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.678 -0.692 . . . . 63.41 112.71 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -62.58 -29.2 70.42 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.279 0.474 . . . . 75.22 112.279 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -66.68 -41.45 88.08 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.076 0.465 . . . . 62.55 110.144 174.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.3 t -57.37 -39.95 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.017 -0.538 . . . . 64.23 110.525 174.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -59.17 -42.05 89.88 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.168 0.509 . . . . 63.12 110.628 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.5 t -67.8 -35.83 79.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.028 -0.533 . . . . 72.4 111.745 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -55.78 -30.63 61.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.658 0.266 . . . . 74.02 111.523 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 82' ' ' ILE . 22.6 t -52.94 -37.41 60.95 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.009 0.433 . . . . 74.12 111.131 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -59.69 -49.11 79.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.112 0.482 . . . . 70.12 111.104 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.28 -41.46 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.97 -0.559 . . . . 65.44 110.996 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.403 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.4 mmt -58.04 -37.78 75.02 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.951 -0.568 . . . . 63.35 111.464 178.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' SER . 80.1 mt -63.42 -38.12 81.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 120.845 0.355 . . . . 72.32 111.045 173.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 35.7 m80 -62.23 -33.42 74.55 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.669 0.271 . . . . 73.53 111.613 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.534 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 95.7 t -56.27 -34.64 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-O 120.988 0.423 . . . . 74.21 111.442 177.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 74.2 m-85 . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 112.563 0.579 . . . . 72.41 112.563 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.5 m95 . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 113.182 0.808 . . . . 73.13 113.182 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.78 -37.76 70.5 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 121.189 -0.529 . . . . 74.04 113.061 177.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.534 ' HD3' ' O ' ' A' ' 84' ' ' VAL . 3.7 mmp_? -61.6 -36.78 81.66 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.77 0.319 . . . . 71.23 111.781 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.01 -44.89 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.121 0.486 . . . . 74.03 110.723 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -58.41 -49.64 81.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.037 -0.529 . . . . 74.22 111.055 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.4 m -57.05 -47.66 80.42 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.796 0.331 . . . . 71.41 111.49 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.492 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 31.6 tp -58.65 -55.77 30.85 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.193 0.52 . . . . 62.44 112.068 -178.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.477 HG22 ' CD2' ' A' ' 16' ' ' TYR . 41.4 mt -70.46 -34.82 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 116.188 -0.46 . . . . 71.43 111.587 -174.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.5 m -66.54 -41.9 88.01 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.764 -0.198 . . . . 73.44 111.38 177.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.437 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.7 t80 -62.16 -43.8 98.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.705 0.288 . . . . 63.32 110.691 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.98 -45.57 86.47 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.891 -0.671 . . . . 70.13 112.375 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.549 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.83 -33.78 76.36 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.844 0.354 . . . . 73.21 111.816 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -65.61 -43.27 90.09 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.96 0.41 . . . . 71.21 110.54 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 101' ' ' PHE . 48.9 t -65.91 -38.47 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-O 120.851 0.358 . . . . 65.12 110.439 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.63 -41.2 69.76 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.185 -0.462 . . . . 64.21 111.865 177.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -54.34 -48.91 70.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.528 0.68 . . . . 71.32 110.619 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.471 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.4 t60 -67.05 -39.71 86.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.76 -0.655 . . . . 74.22 111.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -58.65 -50.14 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.737 0.303 . . . . 65.41 111.331 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.57 -45.95 90.33 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.084 0.469 . . . . 72.13 111.035 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 63.2 m -55.68 -40.23 72.02 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.937 -0.574 . . . . 43.14 112.231 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.4 pt -96.57 21.2 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.507 0.558 . . . . 64.21 112.507 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 69.16 10.43 7.84 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.832 0.679 . . . . 65.2 112.832 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -92.12 27.45 2.17 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.024 0.44 . . . . 73.22 110.589 175.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.514 ' HG3' HD12 ' A' ' 118' ' ' ILE . 70.8 tt0 -58.93 -34.86 72.21 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.342 0.497 . . . . 72.15 112.342 -174.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.9 m -56.92 -31.98 65.47 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.927 0.394 . . . . 75.52 111.195 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -64.74 -26.37 68.33 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.396 0.517 . . . . 72.14 112.396 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.514 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.0 mt -53.67 -41.22 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 112.725 0.639 . . . . 72.54 112.725 -176.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.04 -54.64 9.44 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 112.403 0.519 . . . . 74.24 112.403 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.13 -29.34 86.93 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 121.712 1.608 . . . . 75.13 112.263 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.7 tt -65.01 -46.39 81.55 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.867 -0.42 . . . . 75.04 109.867 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.561 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.93 -40.78 77.01 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.819 173.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.567 ' HG2' HD11 ' A' ' 10' ' ' LEU . 42.1 mt-10 -63.98 -32.87 74.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.095 -0.502 . . . . 73.23 111.162 177.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.0 m -68.01 -38.64 82.84 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.59 0.234 . . . . 72.44 111.186 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -58.34 -53.27 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.227 0.537 . . . . 75.44 110.405 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 61.0 m -64.11 -35.15 79.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.838 -0.619 . . . . 64.44 111.203 176.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 23.3 t70 -59.97 -52.58 64.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.536 0.199 . . . . 72.21 111.536 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 96.3 t -63.65 -45.46 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.14 0.495 . . . . 63.45 110.651 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.553 ' HG ' HD11 ' A' ' 137' ' ' LEU . 46.4 tp -51.58 -52.13 49.83 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.785 -0.643 . . . . 75.54 111.079 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.543 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -69.36 -37.04 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.89 -0.595 . . . . 70.32 111.836 177.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.4 tpt180 -58.4 -35.89 72.71 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.17 -0.468 . . . . 72.03 112.151 -174.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.409 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.6 t -123.26 -16.74 6.82 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.365 0.876 . . . . 74.43 113.365 -177.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.409 ' HG2' HG23 ' A' ' 132' ' ' THR . 45.3 mmtm -132.39 16.49 4.48 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.965 1.098 . . . . 72.33 113.965 -172.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.584 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.7 ttp180 -60.33 -50.8 72.17 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.786 0.721 . . . . 75.15 111.304 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 30.7 t70 -55.64 -44.74 77.43 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.061 0.458 . . . . 75.02 110.653 177.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -63.34 -36.59 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.366 -0.379 . . . . 72.23 111.867 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.553 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.0 mt -57.0 -50.44 72.71 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.679 0.276 . . . . 72.44 111.275 174.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -77.8 -32.28 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 112.546 0.573 . . . . 74.33 112.546 -177.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.6 mmtt -72.36 -51.9 18.5 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.069 -0.395 . . . . 54.35 111.585 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -86.1 -9.33 56.89 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.467 -0.333 . . . . 73.41 111.762 -177.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mtt-85 61.61 60.16 1.69 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.403 0.621 . . . . 71.54 110.124 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -48.06 -49.62 23.62 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 115.1 -0.954 . . . . 53.22 115.354 -171.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -69.07 -43.19 75.08 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 117.428 0.614 . . . . 74.24 112.046 -174.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.5 -32.8 73.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.212 0.529 . . . . 64.54 110.83 174.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.52 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -74.3 -30.53 60.51 Favored Glycine 0 CA--C 1.525 0.66 0 CA-C-N 116.002 -0.544 . . . . 71.21 112.74 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -57.33 -42.94 82.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 71.42 111.133 177.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE3' ' A' ' 39' ' ' LYS . 30.8 t -68.03 -42.17 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 115.926 -0.579 . . . . 74.31 111.781 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.52 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.9 pt-20 -71.82 -32.1 67.23 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.655 0.264 . . . . 73.43 111.518 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.67 -49.36 78.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.853 0.359 . . . . 74.33 111.523 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -83.58 -1.8 54.64 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.819 0.303 . . . . 75.43 111.819 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 37.3 t60 59.66 21.91 10.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.741 0.416 . . . . 74.21 111.915 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.41 HG11 ' NH1' ' A' ' 46' ' ' ARG . 94.6 t . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 120.976 0.417 . . . . 63.11 112.089 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 113.349 0.87 . . . . 73.44 113.349 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.48 -44.45 80.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.336 -0.847 . . . . 73.43 110.702 173.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 137' ' ' LEU . 60.0 tp -54.69 -43.71 72.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.838 -0.619 . . . . 65.34 111.782 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -68.31 -50.4 53.72 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.813 0.34 . . . . 72.04 111.365 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -63.55 -37.84 88.83 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.096 0.406 . . . . 71.34 112.096 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 8.2 tt0 -69.44 -52.25 28.52 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.425 -0.352 . . . . 74.33 111.189 178.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -59.44 -51.86 68.08 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.716 0.293 . . . . 74.53 111.285 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.3 -45.0 65.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.284 -0.416 . . . . 74.31 111.689 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.554 ' HG2' ' HD2' ' A' ' 15' ' ' ARG . 28.2 tt0 -62.79 -51.56 66.62 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.72 0.295 . . . . 64.45 111.228 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' GLN . 72.0 mt -55.24 -48.76 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.072 0.463 . . . . 63.33 111.444 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.475 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.9 mt -64.04 -50.27 77.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 116.117 -0.492 . . . . 73.31 111.571 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 28.7 t -53.62 -54.23 40.57 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.812 0.339 . . . . 64.43 111.769 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.554 ' HD2' ' HG2' ' A' ' 11' ' ' GLU . 55.0 mtp180 -58.06 -50.29 73.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.299 -0.409 . . . . 75.34 111.386 -178.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.64 -47.45 73.49 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.796 0.331 . . . . 70.34 111.444 177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 13' ' ' ILE . 8.3 mp -59.11 -45.45 90.87 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.781 0.289 . . . . 71.03 111.781 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.4 mmm180 -62.58 -53.06 60.22 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.652 0.263 . . . . 72.53 111.217 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.526 ' OE2' ' HD3' ' A' ' 45' ' ' ARG . 10.1 pt-20 -64.86 -35.02 79.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.832 0.349 . . . . 73.34 111.889 -178.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.553 ' HG2' ' HB1' ' A' ' 103' ' ' ALA . 8.1 tp-100 -69.5 -25.75 64.2 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.959 0.409 . . . . 73.2 111.121 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.71 -31.29 21.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.122 0.416 . . . . 71.33 112.122 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' ARG . 66.4 p -87.71 -37.75 16.41 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.191 0.441 . . . . 50.01 112.191 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.98 0 CA-C-N 116.216 -0.447 . . . . 65.25 112.379 -173.865 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.777 0 N-CA-C 113.701 0.241 . . . . 53.32 113.701 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.71 -50.36 60.67 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.572 0.582 . . . . 55.11 112.572 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.2 m -55.17 -51.62 65.92 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.125 0.417 . . . . 71.45 112.125 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.6 m -60.61 -42.44 96.81 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.921 0.341 . . . . 74.22 111.921 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.79 -42.08 96.86 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.046 0.451 . . . . 73.43 110.891 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -64.34 -43.64 93.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.892 -0.595 . . . . 70.2 111.408 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.51 -55.12 37.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.764 0.316 . . . . 71.01 111.538 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.2 tp -54.7 -41.68 70.57 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.204 0.526 . . . . 75.14 110.973 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -62.5 -47.14 85.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.818 -0.628 . . . . 72.51 111.479 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.577 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.2 m -61.87 -41.39 97.79 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.134 -0.484 . . . . 74.41 111.521 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.3 mt -53.6 -33.67 55.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.181 0.438 . . . . 71.01 112.181 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.526 ' HD3' ' OE2' ' A' ' 19' ' ' GLU . 42.7 mtm-85 -72.75 -55.29 6.98 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.855 0.317 . . . . 70.35 111.855 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -63.1 -37.19 86.23 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.819 0.674 . . . . 63.1 112.819 -176.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 43' ' ' THR . 15.5 m -91.96 -31.18 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 O-C-N 122.052 -0.405 . . . . 70.21 111.948 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.52 -43.78 85.32 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 121.291 -0.48 . . . . 42.23 114.061 -175.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -51.7 -53.5 38.52 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 117.0 0.4 . . . . 64.02 111.977 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.82 -46.74 74.98 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 121.105 -0.569 . . . . 70.43 112.864 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.6 t -58.46 -49.16 83.15 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 120.818 0.342 . . . . 53.24 111.117 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -57.12 -44.24 83.09 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.365 -0.38 . . . . 72.3 111.929 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -68.73 -51.07 45.37 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.331 0.493 . . . . 61.32 112.331 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -61.9 -36.81 82.43 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.412 0.625 . . . . 73.2 111.385 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.32 -16.67 57.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.501 -0.772 . . . . 74.33 112.988 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.32 -50.0 22.79 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.911 0.708 . . . . 72.12 112.911 -171.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.9 t -53.81 -40.43 66.36 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.859 0.361 . . . . 61.13 111.791 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.57 -41.33 60.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.724 0.297 . . . . 73.21 111.547 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -62.69 -47.58 83.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.402 -0.363 . . . . 65.12 111.535 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -53.11 -39.02 63.1 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.131 0.491 . . . . 72.03 110.993 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.53 -29.57 69.84 Favored Glycine 0 CA--C 1.528 0.845 0 CA-C-N 115.945 -0.571 . . . . 63.43 113.063 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 63.5 mtm -89.61 -42.11 11.59 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 122.379 -0.483 . . . . 73.44 111.596 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -55.09 -35.51 64.68 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.232 0.456 . . . . 70.21 112.232 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -63.56 -22.05 66.68 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 112.495 0.554 . . . . 74.04 112.495 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.426 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -108.2 10.58 27.86 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.424 0.631 . . . . 72.52 111.21 174.42 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 65' ' ' LYS . 91.6 mt -117.18 -76.18 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.775 -0.648 . . . . 62.04 110.274 175.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.9 t0 71.12 -40.72 0.48 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.287 1.035 . . . . 65.01 113.426 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.559 HD11 HD21 ' A' ' 77' ' ' LEU . 3.0 mp 60.42 94.25 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.975 0.91 . . . . 63.34 112.541 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.76 -10.1 17.66 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.201 -0.454 . . . . 74.34 111.165 176.631 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -158.73 169.58 24.07 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.39 -0.368 . . . . 72.15 111.252 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.52 -32.19 66.8 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.171 0.804 . . . . 73.14 113.171 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.21 -33.38 58.14 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.946 0.403 . . . . 74.51 111.722 177.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -71.46 -39.56 70.87 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.015 0.436 . . . . 70.3 110.458 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -58.67 -45.45 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.253 0.549 . . . . 74.15 110.805 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.59 -33.19 73.47 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.195 0.522 . . . . 61.23 111.077 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.6 m -69.21 -29.19 67.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.165 -0.47 . . . . 61.33 111.327 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 68' ' ' ILE . 94.0 mt -61.77 -35.39 77.99 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.78 0.324 . . . . 64.14 110.813 174.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -55.47 -39.2 70.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.064 0.459 . . . . 74.01 111.013 175.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -62.3 -41.55 98.61 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.238 -0.437 . . . . 73.43 110.706 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.434 ' O ' HG23 ' A' ' 84' ' ' VAL . 83.7 t -59.35 -43.51 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 120.928 0.394 . . . . 62.24 110.47 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.485 ' HB2' HG21 ' A' ' 128' ' ' VAL . 18.9 mmt -56.74 -43.61 80.89 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.994 -0.548 . . . . 75.1 111.16 177.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 69.6 mt -59.08 -34.5 53.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.183 0.516 . . . . 70.51 110.964 175.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -73.08 -32.24 64.88 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 116.199 -0.455 . . . . 43.1 111.366 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' VAL . 88.0 t -59.45 -38.38 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-O 120.903 0.383 . . . . 73.11 111.924 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.411 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 72.6 m-85 . . . . . 0 N--CA 1.47 0.552 0 N-CA-C 112.192 0.441 . . . . 65.43 112.192 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.461 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 71.8 m95 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 112.033 0.383 . . . . 71.13 112.033 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.34 82.55 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.252 -0.499 . . . . 31.13 112.905 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' A' ' 94' ' ' ARG . 25.4 mmt180 -70.91 -32.49 69.44 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.464 -0.433 . . . . 74.22 111.117 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.413 HG13 ' HE3' ' A' ' 92' ' ' TRP . 46.3 mm -62.21 -46.29 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.032 0.444 . . . . 72.24 110.546 174.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -57.41 -48.25 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 116.129 -0.487 . . . . 71.03 110.869 174.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.1 m -56.55 -43.27 79.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.247 -0.433 . . . . 73.43 111.654 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 33.5 tp -59.3 -55.23 37.51 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.211 0.529 . . . . 72.24 111.652 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.1 mt -68.84 -34.08 62.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.071 -0.513 . . . . 75.33 111.449 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -64.91 -45.17 86.99 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.466 -0.333 . . . . 72.52 111.409 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -62.16 -43.06 99.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.77 0.319 . . . . 75.25 110.651 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -46.45 92.03 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.872 -0.68 . . . . 14.22 112.417 175.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 20' ' ' GLN . . . -66.73 -31.95 72.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.076 0.465 . . . . 65.35 111.951 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.19 -48.44 70.65 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.833 0.349 . . . . 63.23 110.571 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.9 t -65.44 -36.48 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.884 0.373 . . . . 74.43 110.573 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.34 -43.75 67.95 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.065 -0.516 . . . . 74.22 111.728 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -54.57 -49.54 70.09 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.149 0.5 . . . . 71.1 110.771 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.476 ' O ' HG12 ' A' ' 112' ' ' ILE . 79.1 t60 -60.87 -40.19 92.03 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.037 -0.529 . . . . 74.41 111.36 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 88.2 mt -62.17 -50.46 71.76 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.715 0.293 . . . . 74.45 111.658 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.473 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.0 tttm -62.89 -33.53 75.49 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.201 0.524 . . . . 75.34 111.212 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.9 m -64.14 -45.38 88.77 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.196 -0.456 . . . . 72.33 111.721 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.512 HG13 ' HG2' ' A' ' 114' ' ' GLN . 47.2 pt -90.33 24.64 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 N-CA-C 112.674 0.62 . . . . 74.41 112.674 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 69.28 12.49 8.4 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.848 0.685 . . . . 72.05 112.848 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.512 ' HG2' HG13 ' A' ' 112' ' ' ILE . 13.6 mm100 -99.61 36.99 1.67 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.071 -0.393 . . . . 70.04 111.633 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.89 -32.81 69.84 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.794 0.331 . . . . 71.2 111.492 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.442 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 52.4 m -53.79 -41.42 67.22 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.93 0.395 . . . . 61.31 111.344 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.457 ' HB2' HD13 ' A' ' 109' ' ' LEU . 53.1 m -56.9 -27.41 60.68 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.844 0.683 . . . . 74.12 112.844 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 63.9 mt -57.77 -33.55 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 112.203 0.446 . . . . 43.44 112.203 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.79 -54.61 6.15 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 112.481 0.549 . . . . 72.4 112.481 -177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.442 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.5 Cg_endo -59.52 -26.38 81.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.518 1.479 . . . . 72.12 111.799 172.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.434 HD12 HD11 ' A' ' 109' ' ' LEU . 6.5 tt -66.19 -46.13 78.37 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.661 -0.496 . . . . 74.52 109.661 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.14 -44.58 87.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.252 -0.431 . . . . 75.11 110.802 174.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -58.82 -39.48 81.3 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.4 -0.364 . . . . 71.33 111.176 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -61.67 -41.83 98.09 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.918 0.39 . . . . 62.1 111.006 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 121' ' ' LEU . 39.7 mm -60.79 -54.1 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-O 121.126 0.489 . . . . 74.53 110.984 177.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.2 m -68.18 -33.64 74.82 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.104 -0.498 . . . . 72.21 112.084 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.8 t70 -61.03 -52.46 64.9 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.283 -0.261 . . . . 64.54 110.788 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 81' ' ' MET . 80.4 t -64.51 -39.3 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.141 0.496 . . . . 72.14 110.975 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.529 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -58.93 -53.49 57.8 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.012 -0.54 . . . . 72.43 111.68 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.408 HG13 ' HB2' ' A' ' 134' ' ' ARG . 89.8 t -76.34 -33.79 24.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 111.955 0.354 . . . . 65.22 111.955 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 17.1 tpp180 -53.14 -33.36 52.11 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.246 0.461 . . . . 73.34 112.246 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.49 -28.75 2.04 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.679 0.992 . . . . 65.41 113.679 -175.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -104.31 9.4 35.93 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 112.757 0.651 . . . . 73.54 112.757 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.408 ' HB2' HG13 ' A' ' 130' ' ' VAL . 20.3 ttt180 -50.83 -53.35 32.91 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 121.091 0.472 . . . . 71.52 112.245 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.35 -47.94 74.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 65.31 111.985 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.45 -36.83 85.05 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.279 -0.263 . . . . 74.12 111.463 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.529 HD11 ' HG ' ' A' ' 129' ' ' LEU . 73.3 mt -57.05 -51.0 71.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.75 0.309 . . . . 70.21 111.507 176.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.5 p -77.96 -40.8 27.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 112.512 0.56 . . . . 73.32 112.512 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -63.0 -57.34 11.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.255 0.465 . . . . 72.13 112.255 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -84.88 -3.9 58.88 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.711 0.291 . . . . 75.25 111.324 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 62.29 89.71 0.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.382 0.611 . . . . 63.03 110.535 -173.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.461 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -58.97 -62.24 6.45 Favored Glycine 0 CA--C 1.521 0.438 0 CA-C-N 115.656 -0.702 . . . . 74.0 114.219 -170.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -71.55 -16.6 62.32 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.168 0.433 . . . . 71.52 112.168 -173.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -80.52 -58.08 3.28 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.989 0.423 . . . . 75.04 110.806 173.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.423 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -60.47 -34.78 86.93 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.876 -0.602 . . . . 65.3 113.1 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -54.81 -49.3 71.34 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.963 0.505 . . . . 74.42 111.508 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.66 -42.6 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.173 -0.467 . . . . 72.31 112.222 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.423 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.5 pt-20 -73.34 -27.76 61.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 111.92 0.341 . . . . 75.44 111.92 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -63.69 -45.75 88.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.182 0.515 . . . . 63.33 110.874 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -81.85 3.43 26.08 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.231 -0.441 . . . . 72.51 111.558 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 2.0 t60 58.91 37.32 24.72 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.065 0.546 . . . . 43.15 112.057 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 CA--C 1.542 0.65 0 CA-C-O 120.953 0.406 . . . . 64.41 111.772 -179.388 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.4 t70 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 110.439 -0.208 . . . . 74.21 110.439 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.29 -42.58 91.62 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.684 0.278 . . . . 74.04 110.427 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.92 -40.61 70.04 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.022 0.439 . . . . 61.44 110.975 177.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -67.65 -39.6 84.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.154 -0.475 . . . . 73.23 110.999 176.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -67.65 -51.25 52.19 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.175 0.435 . . . . 63.34 112.175 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.508 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -52.23 -52.04 54.76 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.755 0.312 . . . . 73.13 111.382 175.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.4 p -63.98 -54.63 31.38 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 111.954 0.353 . . . . 60.31 111.954 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.7 tp -52.89 -45.48 67.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.232 0.456 . . . . 71.4 112.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -62.55 -45.46 92.83 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 120.681 0.277 . . . . 73.3 111.248 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 8' ' ' GLN . 86.0 mt -57.63 -51.34 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.243 0.544 . . . . 74.41 111.093 176.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.463 ' O ' HD13 ' A' ' 17' ' ' LEU . 77.8 mt -61.34 -47.87 91.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 115.759 -0.655 . . . . 65.23 111.486 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 41.8 t -54.35 -50.35 67.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.976 0.417 . . . . 70.41 111.467 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 35.2 mtp180 -61.33 -48.35 81.7 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.362 -0.381 . . . . 74.2 111.621 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 32.1 t80 -53.4 -48.78 68.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.879 0.371 . . . . 65.02 111.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.51 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.3 mp -59.61 -42.74 93.33 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.662 0.268 . . . . 73.15 111.421 175.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' SER . 37.2 mmt180 -60.39 -43.9 96.21 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.65 0.262 . . . . 70.13 111.429 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 81.1 mt-10 -63.98 -42.63 97.18 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.009 0.433 . . . . 74.42 111.488 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 27.7 mm-40 -71.99 -26.07 62.09 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.07 0.396 . . . . 75.53 112.07 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.427 ' O ' ' HD3' ' A' ' 110' ' ' LYS . . . -84.82 -44.39 13.31 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.33 0.492 . . . . 64.03 112.33 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -87.62 -30.19 20.65 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.017 0.377 . . . . 75.31 112.017 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.889 0 C-N-CA 121.338 -0.458 . . . . 55.42 112.876 -176.684 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.79 0 N-CA-C 112.987 -0.045 . . . . 71.45 112.987 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.507 ' HB1' ' HE2' ' A' ' 39' ' ' LYS . . . -54.31 -39.13 66.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.794 0.33 . . . . 74.5 111.576 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.6 m -54.69 -52.33 62.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.06 0.457 . . . . 71.35 111.576 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 59.6 p -67.36 -31.13 71.17 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.842 0.353 . . . . 64.12 111.856 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.443 ' HG3' HH11 ' A' ' 38' ' ' ARG . 1.1 tmm_? -66.49 -53.39 35.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.305 0.574 . . . . 73.32 110.143 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HE2' ' HB1' ' A' ' 35' ' ' ALA . 63.3 mttm -60.95 -39.32 89.04 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.625 -0.716 . . . . 61.03 111.268 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.86 -47.46 82.64 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.409 -0.36 . . . . 74.02 111.706 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.38 -52.62 63.86 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 111.846 0.313 . . . . 72.45 111.846 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.97 -39.77 90.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.771 0.319 . . . . 75.4 111.226 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.572 ' O ' HG22 ' A' ' 47' ' ' VAL . 63.7 m -66.15 -50.06 65.26 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.562 0.22 . . . . 53.14 110.818 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.9 mt -53.99 -45.18 71.36 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.258 0.466 . . . . 64.14 112.258 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HA ' ' CE1' ' A' ' 16' ' ' TYR . 5.0 ptm180 -73.97 -39.03 63.98 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 111.784 0.29 . . . . 72.34 111.784 -176.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -71.97 -35.16 69.46 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.296 -0.253 . . . . 74.43 111.679 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 43' ' ' THR . 17.6 m -87.92 -33.47 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.043 0.449 . . . . 64.44 111.366 177.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -64.3 -42.31 97.85 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-N 116.24 -0.437 . . . . 71.05 113.507 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -54.5 -42.74 71.11 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.912 0.386 . . . . 72.32 111.425 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.6 -43.65 91.64 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.104 -0.569 . . . . 70.3 112.618 176.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 47' ' ' VAL . 97.3 t -59.62 -41.17 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 120.709 0.29 . . . . 65.21 111.318 177.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 78.9 mt-30 -57.96 -41.42 82.85 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.565 -0.289 . . . . 60.5 111.573 178.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 53' ' ' ARG . 16.1 mmm-85 -61.98 -56.1 22.62 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.575 0.583 . . . . 71.24 112.575 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -70.81 -21.84 62.42 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.031 -0.418 . . . . 51.4 111.785 -177.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 24.8 m80 -90.46 -20.47 22.7 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.514 0.561 . . . . 73.52 112.514 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -50.08 -49.57 50.95 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.729 0.64 . . . . 53.25 112.729 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -58.93 -34.01 71.24 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.852 0.358 . . . . 71.44 111.859 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.1 -43.83 23.29 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.889 0.376 . . . . 74.34 111.718 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -64.56 -39.65 94.13 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.483 -0.326 . . . . 71.2 111.373 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -53.0 -41.53 64.72 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.0 0.429 . . . . 74.21 110.816 173.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -62.74 -27.0 69.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 115.904 -0.589 . . . . 73.01 112.958 175.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.574 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 81.5 mtp -81.4 -51.42 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 122.637 -0.331 . . . . 74.51 110.97 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.9 mp -55.0 -37.44 66.6 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.542 0.571 . . . . 71.25 112.542 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -66.41 -25.43 66.76 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 111.978 0.362 . . . . 63.2 111.978 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -96.31 -16.18 21.49 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 122.106 -0.371 . . . . 73.05 110.877 175.422 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.31 -68.26 0.71 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.375 -0.375 . . . . 73.33 111.16 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 54.37 97.71 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.389 0.614 . . . . 63.34 111.938 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.504 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.3 mp -93.1 100.58 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.157 0.503 . . . . 62.51 111.19 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.423 ' HD3' HD22 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -107.27 -6.58 17.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.174 -0.466 . . . . 74.14 112.147 179.198 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.423 HD22 ' HD3' ' A' ' 69' ' ' LYS . 0.8 OUTLIER -155.42 174.85 14.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.825 0.345 . . . . 75.14 111.37 177.646 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.4 -37.37 83.2 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.289 0.477 . . . . 75.3 112.289 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.27 -39.19 66.65 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.788 0.327 . . . . 75.34 111.487 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' ILE . 48.1 m-20 -63.75 -38.28 90.5 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.066 0.46 . . . . 64.32 110.916 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.38 -46.08 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.337 0.589 . . . . 65.3 110.844 175.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 78' ' ' SER . 98.2 mttt -70.0 -23.93 63.22 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.137 -0.483 . . . . 72.11 111.223 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.2 t -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.074 0.464 . . . . 74.53 110.403 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.5 mt -57.2 -37.93 72.93 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.345 -0.388 . . . . 62.03 110.464 174.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 38.5 t -53.25 -37.9 62.51 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.14 -0.482 . . . . 71.13 111.469 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -40.27 97.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.197 0.522 . . . . 74.33 110.54 177.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.5 t -66.94 -39.79 84.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.072 -0.513 . . . . 64.43 110.647 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.543 ' HB3' HD11 ' A' ' 98' ' ' LEU . 21.4 mmt -55.39 -40.51 71.48 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.864 -0.607 . . . . 54.15 111.211 177.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' SER . 73.7 mt -60.74 -33.55 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 116.078 -0.51 . . . . 75.43 111.349 174.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -72.8 -28.86 62.82 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.516 -0.311 . . . . 65.24 111.687 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 92.2 t -58.02 -28.84 34.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 121.064 0.459 . . . . 63.45 111.711 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.509 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 74.0 m-85 . . . . . 0 CA--C 1.543 0.674 0 N-CA-C 112.853 0.686 . . . . 75.51 112.853 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.494 ' HE3' HG13 ' A' ' 95' ' ' ILE . 81.8 m95 . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 112.525 0.565 . . . . 71.01 112.525 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.1 -31.59 73.42 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.189 -0.529 . . . . 71.1 112.786 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' A' ' 85' ' ' PHE . 65.8 mtm180 -66.23 -36.2 82.39 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.393 -0.475 . . . . 71.41 111.188 175.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.494 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.4 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.134 0.492 . . . . 74.2 110.501 176.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.19 -49.91 81.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.115 -0.493 . . . . 60.35 111.178 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.8 m -56.01 -41.96 75.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.39 -0.368 . . . . 72.02 111.473 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.543 HD11 ' HB3' ' A' ' 81' ' ' MET . 35.9 tp -61.33 -55.1 35.45 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.27 0.557 . . . . 74.44 111.896 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.401 HG23 HG23 ' A' ' 13' ' ' ILE . 58.0 mt -72.04 -35.26 53.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 116.14 -0.482 . . . . 73.53 111.955 -174.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.2 p -64.7 -44.89 88.81 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.581 0.229 . . . . 63.33 111.044 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -60.26 -41.32 93.01 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.797 0.332 . . . . 74.33 110.991 176.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.71 -43.83 94.33 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.858 -0.686 . . . . 62.44 112.468 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.14 -35.18 79.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.981 0.42 . . . . 74.22 111.439 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.413 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 51.3 t80 -62.44 -42.61 99.59 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.229 -0.441 . . . . 72.34 111.018 177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.442 ' HB ' HD11 ' A' ' 121' ' ' LEU . 47.3 t -71.46 -38.3 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.737 0.303 . . . . 71.35 110.863 175.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.97 73.33 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.345 0.498 . . . . 55.13 112.345 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 19.4 ptpt -61.43 -36.16 79.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.111 0.481 . . . . 72.44 110.925 178.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -68.58 -34.72 76.3 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.376 -0.375 . . . . 74.04 110.89 176.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.498 HD11 HD12 ' A' ' 121' ' ' LEU . 90.0 mt -62.63 -50.36 71.55 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.639 0.257 . . . . 63.22 111.073 177.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 56.6 tttm -61.74 -35.14 77.23 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.905 0.383 . . . . 74.4 111.041 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.2 m -60.48 -41.14 93.62 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.414 -0.357 . . . . 73.54 111.491 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.4 pt -92.94 18.88 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.864 0.364 . . . . 74.11 111.876 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 67.59 16.21 9.85 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.182 0.808 . . . . 73.41 113.182 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -91.95 40.84 1.05 Allowed 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.96 0.409 . . . . 52.1 110.795 173.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.98 -40.8 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.017 0.527 . . . . 71.34 111.812 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 88.3 p -62.94 -33.59 75.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.027 0.38 . . . . 73.22 112.027 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.428 ' HB2' HD13 ' A' ' 109' ' ' LEU . 49.4 m -58.24 -26.11 62.5 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.353 0.501 . . . . 72.41 112.353 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 70.0 mt -54.38 -36.03 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 112.295 0.48 . . . . 62.43 112.295 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -67.08 -58.3 9.45 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 112.331 0.493 . . . . 63.22 112.331 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -57.32 -28.68 81.04 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.634 1.556 . . . . 50.14 112.092 175.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.498 HD12 HD11 ' A' ' 109' ' ' LEU . 5.0 tt -64.41 -50.45 67.55 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 110.008 -0.368 . . . . 72.11 110.008 175.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.28 76.21 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.174 0.511 . . . . 63.44 111.137 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.77 -29.19 67.52 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.325 -0.398 . . . . 71.02 111.594 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.0 m -69.34 -43.52 73.51 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.843 0.354 . . . . 42.15 111.089 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.441 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.6 mm -55.73 -52.92 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.367 0.603 . . . . 65.22 110.43 174.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.4 m -65.43 -35.97 82.52 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.419 -0.81 . . . . 70.34 111.666 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.9 t70 -57.53 -52.54 64.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.733 0.302 . . . . 74.53 110.996 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 132' ' ' THR . 62.1 t -64.36 -42.8 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 120.937 0.399 . . . . 73.1 111.053 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -53.89 -52.84 59.24 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.335 0.588 . . . . 72.44 111.351 178.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.76 -30.74 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.856 -0.611 . . . . 62.24 111.376 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.1 tpt180 -57.47 -49.69 75.47 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.121 0.486 . . . . 63.14 112.179 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.9 t -104.39 -29.56 10.66 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.906 1.076 . . . . 70.52 113.906 -172.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -130.47 22.44 5.13 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.081 1.141 . . . . 74.5 114.081 -171.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' A' ' 137' ' ' LEU . 33.8 ttp180 -54.47 -43.35 71.64 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-O 121.011 0.434 . . . . 71.13 111.983 175.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 33.8 t70 -58.65 -49.58 77.0 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.21 -0.45 . . . . 65.31 111.525 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.46 -35.74 81.82 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.774 0.287 . . . . 72.42 111.774 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.532 HD11 ' HG ' ' A' ' 129' ' ' LEU . 55.9 mt -51.81 -48.45 63.87 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.661 0.267 . . . . 72.32 111.501 174.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.79 -31.85 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 112.446 0.536 . . . . 63.14 112.446 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 45.1 mmtm -65.47 -64.33 0.89 Allowed 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.965 -0.46 . . . . 71.33 112.186 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -85.6 4.02 38.11 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.419 -0.355 . . . . 75.25 111.247 -176.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 51.49 72.17 0.39 Allowed 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.231 0.539 . . . . 72.23 110.084 -172.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.33 -50.29 6.63 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.218 -0.901 . . . . 70.01 114.793 -171.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.457 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.5 m95 -72.95 -26.26 61.32 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.32 0.489 . . . . 74.53 112.32 -175.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -76.42 -53.93 7.45 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.279 0.562 . . . . 72.24 110.587 173.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.446 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -58.39 -33.64 71.82 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.716 -0.675 . . . . 71.41 112.673 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.56 -45.71 81.13 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.301 0.572 . . . . 74.43 111.58 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.499 HG13 ' HB ' ' A' ' 152' ' ' VAL . 47.2 t -70.26 -42.34 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.941 -0.572 . . . . 65.12 112.026 -177.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.446 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.8 pt-20 -73.34 -27.89 61.76 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.783 0.325 . . . . 74.41 111.36 177.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.89 -48.96 78.16 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.575 0.35 . . . . 71.45 111.675 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -83.21 -10.99 58.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 111.961 0.356 . . . . 64.32 111.961 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 65.75 74.83 0.36 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.197 0.522 . . . . 62.51 111.405 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 147' ' ' VAL . 59.9 t . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 73.31 110.158 174.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.5 t70 . . . . . 0 CA--C 1.542 0.648 0 CA-C-O 120.755 0.312 . . . . 72.45 110.668 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -55.52 -41.58 73.31 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.891 0.377 . . . . 44.21 111.305 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.6 tp -55.93 -46.79 78.37 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.045 -0.525 . . . . 40.43 110.9 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -62.72 -43.26 99.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.155 -0.475 . . . . 73.0 110.879 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -58.47 -44.63 89.38 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.341 0.497 . . . . 52.11 112.341 177.807 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.441 ' O ' HG13 ' A' ' 12' ' ' ILE . 47.7 tt0 -73.15 -45.03 59.03 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.707 0.262 . . . . 61.34 111.707 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.0 p -60.91 -53.1 61.45 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.695 0.283 . . . . 62.24 111.148 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.9 tp -54.53 -40.83 69.03 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.379 -0.373 . . . . 54.23 111.559 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.39 -51.64 68.6 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.132 0.491 . . . . 65.01 111.317 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 8' ' ' GLN . 57.2 mt -64.21 -49.75 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.043 -0.526 . . . . 74.11 111.37 -178.411 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.417 ' O ' HD13 ' A' ' 17' ' ' LEU . 86.0 mt -62.32 -47.29 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 116.224 -0.444 . . . . 72.03 111.662 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 39.3 t -54.66 -54.6 39.57 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.512 -0.313 . . . . 73.43 111.642 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -60.27 -45.84 91.89 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.666 -0.243 . . . . 73.25 111.499 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -56.12 -48.54 76.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.884 0.373 . . . . 71.1 111.555 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.1 mp -59.39 -41.89 90.44 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.741 -0.209 . . . . 73.44 111.452 176.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 22.1 mmm180 -63.79 -55.36 23.64 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 111.688 0.255 . . . . 73.41 111.688 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 6.9 pt-20 -61.62 -40.6 95.43 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.015 0.376 . . . . 74.2 112.015 -177.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.7 mm-40 -70.66 -22.74 62.46 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.161 -0.337 . . . . 74.52 111.439 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -80.04 -43.06 22.55 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 111.88 0.326 . . . . 75.32 111.88 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.5 p -87.4 -16.83 33.78 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.924 0.392 . . . . 70.31 111.662 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.699 0 C-N-CA 121.105 -0.569 . . . . 74.11 112.527 -176.569 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.718 0 CA-C-O 120.452 -0.082 . . . . 52.12 113.164 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.38 -49.67 75.44 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.183 0.438 . . . . 73.44 112.183 -176.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.4 m -60.47 -41.06 93.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.092 0.472 . . . . 64.12 111.107 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.3 m -62.99 -42.39 99.83 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.273 -0.422 . . . . 74.34 111.15 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -63.55 -55.95 19.79 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.888 0.375 . . . . 65.33 111.572 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 147' ' ' VAL . 3.2 ptmm? -63.18 -29.36 70.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.34 -0.391 . . . . 73.21 111.404 -174.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.16 82.36 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.929 0.395 . . . . 74.01 111.06 173.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.2 tp -59.22 -54.39 47.43 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.306 -0.407 . . . . 71.32 111.92 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.37 -24.79 64.83 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.025 0.379 . . . . 75.52 112.025 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.495 HG23 HG21 ' A' ' 152' ' ' VAL . 28.3 m -66.49 -42.52 87.28 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 122.106 -0.371 . . . . 75.45 110.3 169.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.4 mt -56.41 -31.89 64.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.691 0.282 . . . . 53.41 111.513 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -68.76 -54.45 15.94 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.289 0.566 . . . . 61.13 110.68 174.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 24.3 ttt180 -56.46 -44.84 80.91 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.287 -0.869 . . . . 63.53 112.416 -177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 43' ' ' THR . 15.6 m -93.72 -33.08 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.179 0.437 . . . . 74.01 112.179 -178.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.63 -49.52 59.52 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.229 -0.51 . . . . 65.44 113.602 -174.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.541 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 14.8 t70 -61.57 -35.99 79.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 117.223 0.512 . . . . 64.31 110.751 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.9 -50.15 70.83 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 121.075 -0.583 . . . . 75.03 112.089 174.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.23 -38.46 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.831 0.348 . . . . 74.12 111.192 176.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.4 mt-30 -57.01 -50.56 72.34 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.616 -0.265 . . . . 73.31 111.2 175.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 15.2 mmp_? -55.26 -50.18 70.14 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.904 0.705 . . . . 73.22 112.904 -175.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -78.39 -23.1 46.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 112.59 0.589 . . . . 71.42 112.59 -177.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -91.68 -16.96 26.2 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.629 0.603 . . . . 72.1 112.629 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -48.61 -57.95 5.44 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.508 0.929 . . . . 74.03 113.508 -167.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -62.49 -31.36 72.09 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.08 0.466 . . . . 63.45 111.523 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.41 -30.5 67.4 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.988 0.423 . . . . 61.34 111.216 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -76.98 -43.04 36.46 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.422 -0.354 . . . . 72.42 111.224 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -52.05 -40.0 60.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.825 0.345 . . . . 64.12 111.49 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.94 -33.36 56.8 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 121.4 -0.429 . . . . 72.55 113.603 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 67.0 mtm -91.0 -37.29 13.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.494 0.664 . . . . 71.25 110.44 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 63' ' ' LEU . 13.4 tp -63.44 -38.08 89.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.483 -0.78 . . . . 72.53 111.786 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.72 -39.8 74.55 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.232 -0.44 . . . . 73.05 112.183 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -2.62 58.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.833 0.349 . . . . 74.13 111.636 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.09 -75.7 0.51 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.94 0.4 . . . . 75.01 110.99 174.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 43.34 83.37 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.48 -0.782 . . . . 62.34 111.063 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.602 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.6 mp -60.31 113.61 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.716 -0.675 . . . . 72.51 112.031 -172.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -104.32 -8.98 18.86 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.986 -0.552 . . . . 61.34 112.155 -179.497 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -166.35 179.75 5.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.911 0.386 . . . . 45.31 111.759 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -53.63 -38.8 64.41 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.563 0.579 . . . . 71.1 112.563 -178.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.16 -39.21 63.41 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.825 0.345 . . . . 61.25 111.79 -178.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.546 ' HB2' HG23 ' A' ' 68' ' ' ILE . 21.7 m-20 -69.26 -34.47 74.82 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.947 0.404 . . . . 73.14 110.812 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.55 -39.58 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.271 0.557 . . . . 75.31 110.324 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -62.95 -38.83 92.66 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.174 0.511 . . . . 74.44 110.451 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 45.7 t -62.86 -34.14 76.75 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.095 -0.502 . . . . 62.52 111.33 174.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.498 HD21 HD11 ' A' ' 68' ' ' ILE . 90.4 mt -62.48 -40.01 95.32 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.734 0.302 . . . . 71.24 111.024 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.5 t -52.53 -38.54 59.89 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.176 0.513 . . . . 71.23 111.194 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -58.09 -41.03 82.6 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.051 -0.522 . . . . 73.31 110.894 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.06 -41.29 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 120.951 0.405 . . . . 63.2 110.725 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.2 mmt -54.7 -40.68 69.41 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.992 -0.549 . . . . 73.0 111.241 178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.31 -32.67 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-O 121.085 0.469 . . . . 60.31 111.313 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -74.31 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 111.829 0.307 . . . . 61.52 111.829 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 67.9 t -57.66 -43.01 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.091 0.472 . . . . 71.34 111.342 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.2 m-85 . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 121.033 0.444 . . . . 73.52 111.963 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.488 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.6 m95 . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 112.423 0.527 . . . . 72.54 112.423 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.36 -35.78 51.46 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.239 -0.505 . . . . 62.04 113.05 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -56.65 -43.05 79.94 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.942 0.401 . . . . 73.12 111.592 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' HE3' ' A' ' 92' ' ' TRP . 43.9 mm -66.68 -43.29 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-O 121.078 0.465 . . . . 72.21 110.322 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.9 t -57.38 -42.32 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.026 -0.534 . . . . 72.04 110.595 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.3 m -57.4 -46.76 83.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 72.42 111.417 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.506 ' HG ' HG23 ' A' ' 125' ' ' ILE . 31.2 tp -58.35 -54.52 46.07 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.142 0.496 . . . . 70.32 111.381 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.2 mt -65.53 -37.96 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.055 -0.52 . . . . 74.03 111.959 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.4 m -63.19 -45.82 89.94 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 116.565 -0.289 . . . . 71.3 111.355 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -65.49 -39.5 91.97 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 120.768 0.318 . . . . 75.54 110.863 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.87 -47.93 85.58 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.962 -0.637 . . . . 54.4 112.377 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.498 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.35 -32.29 73.6 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.854 0.359 . . . . 75.44 111.341 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.456 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 39.0 t80 -63.51 -42.84 98.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.081 0.467 . . . . 51.5 111.12 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.491 HG11 HD11 ' A' ' 77' ' ' LEU . 45.5 t -72.2 -40.47 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.932 0.396 . . . . 72.3 110.674 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.442 ' HB1' HG23 ' A' ' 118' ' ' ILE . . . -58.3 -45.3 88.26 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.139 -0.482 . . . . 63.02 112.291 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 17.1 ptmt -64.12 -32.94 74.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.783 0.325 . . . . 71.3 111.031 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.31 -34.24 75.77 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.748 0.309 . . . . 55.22 110.553 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.602 HD21 ' HB ' ' A' ' 68' ' ' ILE . 92.9 mt -61.82 -49.23 77.12 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.747 0.308 . . . . 72.45 111.148 176.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.425 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 8.5 tmtm? -54.29 -44.3 71.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 110.066 -0.346 . . . . 74.33 110.066 176.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.7 m -52.67 -50.53 63.08 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.223 -0.444 . . . . 53.13 111.863 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 38.6 pt -87.29 15.78 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 68.51 18.29 8.95 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.938 0.718 . . . . 73.24 112.938 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -91.66 43.27 1.13 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.011 0.434 . . . . 71.01 111.265 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.91 -17.54 61.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.078 0.399 . . . . 64.41 112.078 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.446 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 72.2 p -71.48 -48.3 50.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.91 0.386 . . . . 73.51 111.012 173.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.487 ' HB2' HD13 ' A' ' 109' ' ' LEU . 24.5 m -56.7 -28.23 60.47 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.061 -0.518 . . . . 73.53 111.991 -177.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.442 HG23 ' HB1' ' A' ' 106' ' ' ALA . 70.9 mt -55.45 -40.95 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 112.639 0.607 . . . . 71.15 112.639 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.06 -53.95 22.75 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 112.203 0.445 . . . . 63.22 112.203 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.446 ' HD2' ' O ' ' A' ' 116' ' ' SER . 23.5 Cg_endo -62.02 -25.04 77.31 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 121.579 1.519 . . . . 64.24 112.438 173.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 109' ' ' LEU . 3.9 tt -61.25 -46.48 90.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.698 -0.482 . . . . 73.54 109.698 174.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.05 -33.75 65.28 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.052 0.453 . . . . 64.53 111.439 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -68.18 -39.44 82.51 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.198 -0.455 . . . . 74.42 111.914 177.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 98.3 p -63.35 -47.48 81.95 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.815 0.28 . . . . 63.31 111.099 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.506 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.9 mm -52.86 -53.23 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.384 0.611 . . . . 74.21 111.028 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.8 m -66.67 -35.83 81.09 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.671 -0.695 . . . . 65.51 111.612 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.617 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 33.3 t70 -61.0 -53.0 62.63 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.755 -0.202 . . . . 72.55 110.912 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.75 -41.42 92.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 120.95 0.405 . . . . 55.42 111.097 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.6 ' HG ' HD11 ' A' ' 137' ' ' LEU . 24.8 tp -52.9 -52.52 57.28 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.284 0.564 . . . . 61.01 111.036 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 89.2 t -74.16 -35.22 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.97 -0.559 . . . . 55.14 111.576 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.617 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.1 ttt180 -54.83 -32.8 60.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.114 0.566 . . . . 73.13 112.106 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.75 HG23 ' HD2' ' A' ' 133' ' ' LYS . 1.6 t -127.1 -18.97 4.46 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 52.52 113.765 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.75 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.3 mptp? -123.68 20.95 9.34 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.17 0.804 . . . . 74.43 113.17 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 48.3 ttp180 -45.66 -64.11 0.81 Allowed 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.228 0.537 . . . . 72.11 112.424 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.12 -40.24 93.04 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.742 -0.663 . . . . 73.5 111.826 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -60.04 -42.07 93.62 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 122.239 -0.288 . . . . 71.11 111.61 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.6 HD11 ' HG ' ' A' ' 129' ' ' LEU . 83.3 mt -53.18 -52.53 58.54 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.942 0.401 . . . . 75.21 111.523 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.13 -38.33 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 112.326 0.491 . . . . 53.41 112.326 -176.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -65.11 -40.99 95.3 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.22 0.452 . . . . 70.12 112.22 -177.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -89.76 0.94 56.69 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.352 -0.217 . . . . 74.04 111.576 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 55.16 74.06 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.614 0.721 . . . . 65.42 110.07 -173.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.435 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -53.47 -68.58 1.56 Allowed Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.97 -1.014 . . . . 44.23 115.173 -168.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -67.16 -12.42 59.97 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.156 0.428 . . . . 74.1 112.156 -173.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -84.42 -58.37 2.77 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.993 0.425 . . . . 71.35 110.566 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.545 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -62.58 -30.27 76.12 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.029 -0.532 . . . . 72.42 113.053 178.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -53.96 -47.7 71.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.338 0.589 . . . . 63.01 111.474 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 39' ' ' LYS . 24.3 t -73.79 -39.46 52.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.867 -0.606 . . . . 71.44 112.293 -174.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.545 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 9.2 pt-20 -66.91 -38.65 86.62 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.825 0.345 . . . . 70.33 110.677 176.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' PHE . . . . . 0.434 ' N ' ' HG3' ' A' ' 148' ' ' GLU . 84.3 t80 -53.69 -48.02 69.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.286 -0.416 . . . . 64.11 111.716 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -82.41 -5.47 58.67 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.791 0.329 . . . . 72.4 111.634 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 59.31 26.41 15.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.375 0.67 . . . . 73.41 112.373 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.495 HG21 HG23 ' A' ' 43' ' ' THR . 96.7 t . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 121.023 0.44 . . . . 73.02 112.053 -176.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 CA--C 1.54 0.59 0 CA-C-O 120.874 0.369 . . . . 74.34 110.985 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -54.28 -43.88 71.43 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.14 0.495 . . . . 65.34 111.245 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.2 tp -59.75 -34.91 73.58 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.839 -0.618 . . . . 73.02 111.437 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -66.65 -46.03 77.06 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.37 -0.377 . . . . 65.34 110.331 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -60.75 -43.64 97.7 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.972 0.415 . . . . 75.15 111.22 177.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -56.17 -53.71 53.91 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.343 0.592 . . . . 71.34 111.131 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.3 m -64.98 -43.78 91.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.659 -0.7 . . . . 55.44 111.495 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.78 -44.69 93.78 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.555 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.35 -51.35 69.77 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.263 0.554 . . . . 74.03 111.193 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.449 HG23 ' HB2' ' A' ' 41' ' ' LEU . 68.1 mt -59.85 -54.06 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.93 -0.577 . . . . 74.24 111.6 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.475 HD13 HG22 ' A' ' 125' ' ' ILE . 81.1 mt -61.99 -42.26 94.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 116.132 -0.485 . . . . 72.42 111.822 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.8 t -55.07 -53.88 50.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.89 0.376 . . . . 71.13 111.836 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.69 -39.15 93.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.552 -0.295 . . . . 62.51 111.511 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 57.0 t80 -59.85 -49.06 79.19 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.09 0.471 . . . . 71.11 111.489 178.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.0 mp -62.71 -38.13 89.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.765 0.317 . . . . 73.32 111.211 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -65.73 -43.31 89.41 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.011 0.375 . . . . 62.45 112.011 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 3.2 pt-20 -69.49 -39.65 77.51 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.109 -0.369 . . . . 74.3 111.571 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.506 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.6 mm-40 -71.43 -28.08 63.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.788 0.328 . . . . 74.02 111.397 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.57 -41.87 44.83 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 111.872 0.323 . . . . 62.2 111.872 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.3 p -88.27 -29.97 20.0 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.032 0.444 . . . . 63.11 112.184 -178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.947 0 C-N-CA 121.427 -0.416 . . . . 42.31 112.398 -174.558 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 CA-C-O 120.847 0.137 . . . . 34.44 112.797 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.33 68.44 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.152 0.427 . . . . 75.22 112.152 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.575 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . 59.8 m -59.53 -52.04 67.26 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.276 0.472 . . . . 75.35 112.276 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.9 p -61.05 -45.48 94.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.296 -0.411 . . . . 75.05 111.461 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -46.27 81.7 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 111.864 0.32 . . . . 75.02 111.864 179.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.669 ' HG3' HG21 ' A' ' 147' ' ' VAL . 24.2 pttm -67.17 -28.8 68.41 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.088 -0.382 . . . . 73.15 111.62 -178.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.32 -51.92 64.01 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.925 0.393 . . . . 74.42 110.498 173.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB2' HG23 ' A' ' 12' ' ' ILE . 65.5 tp -59.01 -44.85 91.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.31 0.576 . . . . 72.51 111.208 175.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.37 -41.2 88.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.781 -0.645 . . . . 74.25 111.161 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.1 m -72.1 -38.35 69.35 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.315 -0.402 . . . . 54.32 111.02 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.0 mt -53.64 -47.05 70.68 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 111.944 0.35 . . . . 72.21 111.944 177.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -74.14 -29.78 61.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.774 0.321 . . . . 74.31 111.42 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -63.45 -45.1 92.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.796 0.331 . . . . 72.31 111.396 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.84 -30.4 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.028 0.442 . . . . 71.44 111.468 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.39 -44.39 97.65 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.921 -0.582 . . . . 61.04 112.953 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 23.1 t70 -50.84 -57.37 8.62 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.837 0.351 . . . . 64.21 110.955 176.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.07 -45.13 92.75 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.399 -0.429 . . . . 45.44 113.548 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 85.1 t -62.92 -42.62 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.883 0.373 . . . . 64.55 111.508 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 27.8 mt-30 -66.74 -27.5 67.66 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.024 0.379 . . . . 75.54 112.024 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 21.6 mmt180 -64.07 -42.84 96.84 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.389 . . . . 73.51 111.193 175.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -84.05 -49.82 8.55 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.117 0.484 . . . . 72.33 112.272 -176.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -75.06 -20.99 59.29 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.317 0.858 . . . . 72.04 113.317 -172.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' A' ' 52' ' ' GLN . 42.7 tt0 -50.49 -52.51 37.66 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.102 0.408 . . . . 64.13 112.102 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -55.69 -36.96 67.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.962 0.41 . . . . 61.02 111.824 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.32 62.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.916 0.389 . . . . 74.21 111.565 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -66.17 -37.94 86.84 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.545 -0.298 . . . . 65.33 111.507 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.625 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 79.4 mm-40 -48.86 -49.49 39.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 74.52 111.175 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -32.28 52.93 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.242 -0.436 . . . . 53.11 113.689 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.408 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 46.2 mtm -89.37 -30.22 18.54 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.241 0.543 . . . . 73.22 110.356 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.8 tp -63.04 -30.78 71.87 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 63.23 111.021 -178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.625 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 61.6 mtp180 -68.24 -16.55 64.01 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.934 -0.576 . . . . 72.14 112.222 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.37 5.85 23.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.001 0.429 . . . . 72.04 111.332 176.104 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 98.5 mt -103.85 -73.72 0.66 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.292 -0.413 . . . . 75.23 111.226 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 38.26 87.06 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.125 0.787 . . . . 74.2 113.125 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -65.92 113.5 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.401 -0.818 . . . . 75.45 112.065 -176.097 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -6.03 27.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.375 -0.375 . . . . 53.43 111.641 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -173.36 174.62 3.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 120.932 0.396 . . . . 72.35 111.644 172.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -50.84 -30.48 14.52 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.493 0.553 . . . . 73.42 112.493 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -52.99 -41.75 64.9 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.122 0.487 . . . . 71.34 111.444 176.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 17.4 m-20 -73.18 -28.42 62.2 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.301 -0.409 . . . . 62.3 111.122 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -62.19 -40.92 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.299 0.571 . . . . 74.23 110.386 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.99 -30.72 70.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.042 -0.526 . . . . 74.34 110.851 174.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.5 t -66.06 -37.63 86.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.181 0.515 . . . . 51.42 110.529 171.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.4 mt -62.13 -38.11 87.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.225 -0.443 . . . . 70.53 110.873 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.8 t -52.74 -41.02 63.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.983 0.42 . . . . 72.31 111.198 177.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -55.5 -47.24 76.5 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.752 175.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.61 -41.79 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.969 0.414 . . . . 54.41 111.007 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.488 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.8 mmt -56.18 -41.99 76.39 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.046 -0.525 . . . . 74.55 111.206 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.67 -37.3 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.16 -0.473 . . . . 74.33 110.957 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -65.11 -28.83 69.71 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 122.339 -0.225 . . . . 70.43 111.388 177.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.99 -39.62 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 51.32 110.994 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.542 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 26.9 m-85 . . . . . 0 CA--C 1.54 0.579 0 CA-C-N 116.302 -0.408 . . . . 71.44 112.034 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 94.1 m95 . . . . . 0 N--CA 1.471 0.615 0 N-CA-C 112.109 0.411 . . . . 65.35 112.109 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.94 -26.83 55.88 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 121.416 -0.421 . . . . 53.11 112.998 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -62.67 -42.17 99.48 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.054 0.454 . . . . 53.03 110.369 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -63.27 -45.26 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.896 -0.593 . . . . 72.44 110.561 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.44 -48.41 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.982 -0.553 . . . . 72.34 110.948 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.4 m -57.26 -45.66 83.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.563 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.542 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 23.8 tp -57.77 -54.94 41.2 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.343 0.592 . . . . 73.04 111.797 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.441 HG22 ' CD2' ' A' ' 16' ' ' TYR . 51.7 mt -71.62 -37.53 63.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.864 -0.607 . . . . 71.41 112.08 -174.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 92.3 p -66.94 -44.08 81.53 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.631 0.253 . . . . 42.35 111.263 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.48 -40.19 93.64 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.799 0.333 . . . . 53.32 110.717 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.14 -47.61 86.22 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.895 -0.669 . . . . 75.05 112.365 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.01 79.6 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.098 0.475 . . . . 62.42 111.5 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.426 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 80.2 t80 -62.01 -45.73 92.29 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.059 -0.519 . . . . 74.52 111.325 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 56.2 t -69.93 -38.39 75.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 120.836 0.351 . . . . 75.54 110.787 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.76 69.13 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.292 0.479 . . . . 74.03 112.292 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 18.1 ptpt -62.83 -36.55 83.57 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.851 0.357 . . . . 73.34 111.227 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.423 ' O ' HG12 ' A' ' 112' ' ' ILE . 71.7 t60 -65.3 -33.7 76.59 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.909 0.385 . . . . 65.12 110.33 176.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.504 HD21 ' HB ' ' A' ' 68' ' ' ILE . 89.0 mt -67.41 -50.56 58.96 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.093 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -57.04 -40.57 77.02 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.166 0.508 . . . . 63.43 110.477 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.8 m -55.97 -48.91 74.95 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.604 -0.725 . . . . 43.22 111.699 175.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 108' ' ' HIS . 37.1 pt -88.7 22.2 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 N-CA-C 112.142 0.423 . . . . 52.23 112.142 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 68.32 12.11 8.61 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.918 0.71 . . . . 74.4 112.918 174.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -94.76 38.08 1.12 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.289 0.477 . . . . 71.31 112.289 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.87 -32.27 63.53 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.924 -0.485 . . . . 75.03 110.87 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.7 m -56.9 -29.1 62.71 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.216 -0.447 . . . . 74.33 111.873 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.474 ' HB2' HD13 ' A' ' 109' ' ' LEU . 44.5 m -76.99 -27.07 54.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.485 -0.325 . . . . 55.5 111.706 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.9 mt -59.54 -38.47 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.95 0.352 . . . . 73.02 111.95 -179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.7 -57.17 28.4 Favored Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 112.058 0.392 . . . . 72.13 112.058 -176.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.74 -26.9 60.22 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 121.669 1.579 . . . . 73.02 112.367 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.81 -48.42 76.92 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.706 0.288 . . . . 75.22 110.235 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.39 -40.69 71.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.223 0.535 . . . . 70.42 111.001 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.69 -35.84 79.57 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.928 -0.578 . . . . 64.41 111.357 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.6 m -63.68 -45.41 90.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.731 0.301 . . . . 62.0 111.314 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.477 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.5 mm -54.84 -50.64 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.352 0.596 . . . . 73.12 110.636 175.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 26.7 m -67.93 -33.63 75.06 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.545 -0.752 . . . . 61.15 111.52 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.435 ' O ' ' HD3' ' A' ' 131' ' ' ARG . 15.2 t70 -64.02 -52.73 58.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.375 -0.375 . . . . 51.3 110.681 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 98.5 t -62.49 -41.73 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.149 0.5 . . . . 70.23 110.821 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' ' 137' ' ' LEU . 48.9 tp -54.32 -52.8 60.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.848 -0.614 . . . . 75.23 111.235 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 83.2 t -76.02 -27.33 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.157 -0.474 . . . . 73.32 111.9 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 127' ' ' ASP . 0.7 OUTLIER -54.85 -38.12 67.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.22 0.452 . . . . 75.05 112.22 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.417 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.5 OUTLIER -130.46 -37.41 1.4 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.154 0.798 . . . . 64.34 113.154 -175.776 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.417 ' HD2' HG23 ' A' ' 132' ' ' THR . 0.2 OUTLIER -92.5 6.16 48.15 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.971 0.73 . . . . 40.53 112.971 -177.561 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 12.7 ttp180 -49.83 -64.44 0.81 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.719 0.637 . . . . 74.31 112.719 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.09 -34.06 69.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 75.42 111.924 -178.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' TRP . . . . . 0.411 ' HD1' ' HA ' ' A' ' 133' ' ' LYS . 50.3 m95 -65.79 -36.52 83.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.303 -0.248 . . . . 74.11 111.222 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.582 ' HB2' HD21 ' A' ' 5' ' ' LEU . 78.5 mt -57.7 -49.01 77.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.811 0.338 . . . . 72.0 111.555 175.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.71 -38.02 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 N-CA-C 112.3 0.482 . . . . 73.51 112.3 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -69.66 -50.31 45.28 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.09 0.404 . . . . 73.45 112.09 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -85.41 1.8 47.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.69 0.281 . . . . 72.14 111.342 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 141' ' ' ARG . 23.2 mtp85 51.59 52.75 14.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.078 -0.51 . . . . 75.31 110.919 -175.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -41.89 -58.04 3.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 114.994 0.758 . . . . 50.22 114.994 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -64.25 -20.25 65.92 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 117.512 0.656 . . . . 72.01 112.629 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -86.52 -57.8 2.86 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.942 0.401 . . . . 74.2 111.511 172.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.3 -34.73 89.26 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.363 -0.38 . . . . 63.24 114.007 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -58.12 -37.62 74.93 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.091 0.472 . . . . 65.54 111.708 177.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.669 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.7 t -72.36 -47.81 50.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.928 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -68.51 -28.09 66.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.02 0.438 . . . . 73.4 111.166 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -55.38 -50.84 68.67 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.022 -0.536 . . . . 64.41 110.866 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.58 -25.97 24.7 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.124 -0.489 . . . . 61.51 111.922 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 77.8 t60 71.31 106.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.83 0.852 . . . . 61.21 112.242 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 51.7 t . . . . . 0 CA--C 1.543 0.694 0 CA-C-N 115.977 -0.556 . . . . 73.44 110.925 177.809 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.0 t70 . . . . . 0 CA--C 1.545 0.788 0 CA-C-O 121.15 0.5 . . . . 74.3 111.553 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -58.97 -43.28 91.34 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.139 0.495 . . . . 74.5 111.481 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.9 tp -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.98 -0.555 . . . . 74.21 111.084 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -62.01 -43.34 99.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.952 176.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' ARG . 16.5 mmt180 -69.08 -39.43 79.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.472 0.545 . . . . 64.03 112.472 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -60.84 -49.54 77.08 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.12 0.486 . . . . 71.32 110.742 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.8 m -61.89 -47.31 85.56 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.079 -0.51 . . . . 75.32 111.117 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.47 -37.8 79.14 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.395 -0.366 . . . . 63.32 111.225 177.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.72 -53.68 55.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.332 0.587 . . . . 61.13 110.763 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -63.77 -49.77 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.662 -0.699 . . . . 75.23 111.754 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.3 mt -63.72 -52.12 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 112.146 0.425 . . . . 71.24 112.146 -177.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.6 t -57.17 -48.37 78.89 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-O 120.964 0.411 . . . . 72.14 111.843 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.3 mtp180 -63.4 -40.3 96.84 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.308 -0.405 . . . . 74.14 111.629 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -60.29 -53.33 58.9 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.869 0.366 . . . . 74.32 111.089 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.7 mp -54.92 -39.95 69.34 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.743 0.306 . . . . 65.04 111.293 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -57.22 10.78 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.546 -0.297 . . . . 65.42 111.662 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -61.48 -32.38 72.38 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.0 0.428 . . . . 72.22 111.285 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.423 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 25.4 mm-40 -65.85 -33.98 77.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.176 -0.466 . . . . 72.02 111.852 175.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.98 -41.1 71.45 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.912 0.386 . . . . 71.33 111.433 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.9 p -86.96 -20.75 26.85 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.004 0.43 . . . . 54.35 111.84 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 C-N-CA 121.294 -0.479 . . . . 75.01 112.591 -177.345 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.235 0 N-CA-C 114.633 0.613 . . . . 72.14 114.633 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.79 73.35 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.931 0.715 . . . . 43.22 112.931 -173.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.0 m -54.29 -51.23 65.27 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.129 0.49 . . . . 73.2 111.581 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.6 -35.5 80.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.076 -0.511 . . . . 73.31 111.981 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.436 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 61.3 ttt180 -66.04 -55.79 14.84 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.83 0.348 . . . . 75.43 111.066 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE2' HG11 ' A' ' 147' ' ' VAL . 59.0 mtpt -55.95 -42.29 75.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.085 -0.507 . . . . 71.13 111.352 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.63 -45.57 91.6 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.319 -0.401 . . . . 61.34 111.287 174.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.07 -54.85 35.6 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.892 0.377 . . . . 63.34 111.977 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -66.87 -30.79 71.04 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.919 0.34 . . . . 73.23 111.919 -178.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.552 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -69.72 -40.91 75.97 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.093 -0.38 . . . . 64.13 110.748 174.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.2 mt -53.99 -37.29 63.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.217 0.532 . . . . 74.4 110.595 171.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -68.18 -52.75 30.95 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.146 -0.479 . . . . 72.1 111.712 175.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.545 ' NE ' ' HA ' ' A' ' 43' ' ' THR . 3.2 ptp180 -66.24 -21.65 66.3 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.634 0.605 . . . . 61.03 112.634 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 43' ' ' THR . 23.3 m -110.09 -33.79 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 122.057 -0.402 . . . . 72.21 111.885 176.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.43 -32.57 71.77 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 121.5 -0.381 . . . . 61.45 113.947 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 28.3 t70 -61.9 -52.15 65.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 117.401 0.601 . . . . 74.02 110.757 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.41 -41.53 95.27 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.47 -0.395 . . . . 65.33 112.977 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 47' ' ' VAL . 69.8 t -59.89 -49.65 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 120.8 0.333 . . . . 74.23 111.084 175.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 44.5 mt-30 -57.16 -35.98 70.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.585 -0.28 . . . . 52.03 111.508 177.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.4 mmm180 -58.01 -59.76 4.78 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.795 0.331 . . . . 42.15 111.872 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -74.93 -19.29 60.19 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.095 0.406 . . . . 73.33 112.095 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.471 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 56.7 m80 -90.99 -22.81 20.62 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.529 0.566 . . . . 71.53 112.529 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.49 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 30.0 tt0 -54.56 -51.75 64.24 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.787 0.327 . . . . 64.52 111.818 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -53.37 -29.88 36.76 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.096 0.474 . . . . 73.44 111.771 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.48 -53.86 5.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.073 0.463 . . . . 73.1 111.556 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 15.1 m-85 -58.94 -30.01 67.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.498 0.555 . . . . 74.34 112.498 -177.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -51.16 -40.98 59.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 120.956 0.408 . . . . 75.25 111.404 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.469 ' HA2' ' CZ ' ' A' ' 64' ' ' ARG . . . -61.96 -28.41 70.31 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 121.203 -0.523 . . . . 75.14 113.158 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 81.1 mtp -89.51 -33.23 16.84 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.378 0.608 . . . . 71.33 110.335 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.0 tp -63.46 -41.37 98.61 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.744 -0.662 . . . . 62.54 111.449 -176.358 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.469 ' CZ ' ' HA2' ' A' ' 61' ' ' GLY . 13.3 ptt180 -67.84 -26.0 65.83 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.267 -0.424 . . . . 74.53 111.196 176.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.14 -32.66 56.5 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.069 0.462 . . . . 73.42 111.256 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.75 -73.13 0.41 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.075 -0.511 . . . . 72.3 111.531 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.1 t70 45.35 83.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.438 0.637 . . . . 64.5 111.735 -175.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.473 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.0 mp -64.95 114.62 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 115.9 -0.591 . . . . 64.15 112.17 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.89 -8.06 19.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 111.872 0.323 . . . . 61.13 111.872 175.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -165.6 170.39 14.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.795 0.331 . . . . 60.52 111.738 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HG2' ' HE2' ' A' ' 75' ' ' LYS . 42.5 tt0 -57.22 -28.55 62.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.315 0.487 . . . . 63.35 112.315 -177.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.98 -39.8 75.32 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 122.183 -0.323 . . . . 70.25 111.768 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 33.5 m-20 -60.97 -43.09 99.26 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.499 0.666 . . . . 74.42 109.742 175.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 121' ' ' LEU . 69.4 t -58.87 -38.29 72.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.301 -0.863 . . . . 74.34 111.561 175.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.414 ' HE2' ' HG2' ' A' ' 71' ' ' GLU . 74.5 mmtt -64.7 -40.77 95.94 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.992 0.425 . . . . 71.15 110.729 176.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 t -64.61 -33.82 76.81 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.136 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.7 mt -55.82 -33.34 64.37 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.499 -0.319 . . . . 73.51 111.712 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.3 t -54.7 -39.47 68.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.864 0.364 . . . . 73.24 111.123 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -58.86 -47.58 84.39 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.281 -0.418 . . . . 65.23 111.375 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.34 -40.71 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.066 0.46 . . . . 75.23 111.112 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.516 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.1 mmt -57.82 -40.27 79.59 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.973 -0.558 . . . . 75.35 111.565 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 75.9 mt -57.78 -37.1 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 121.081 0.467 . . . . 55.42 111.085 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -72.29 -27.51 62.51 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.414 -0.357 . . . . 74.34 111.631 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 84.9 t -57.45 -38.36 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 120.907 0.384 . . . . 60.22 111.26 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.446 ' CE2' HD22 ' A' ' 98' ' ' LEU . 39.6 m-85 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 112.547 0.573 . . . . 74.42 112.547 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.3 m95 . . . . . 0 CA--C 1.552 1.046 0 N-CA-C 112.92 0.711 . . . . 73.14 112.92 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.63 55.65 Favored Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.998 -0.439 . . . . 61.32 113.072 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.789 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.1 mmp_? -62.73 -34.59 77.49 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.535 -0.391 . . . . 60.13 111.275 174.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.3 mm -61.93 -45.94 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.207 0.527 . . . . 51.15 109.876 174.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.0 t -57.71 -42.96 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.746 -0.661 . . . . 45.13 110.967 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.4 m -57.7 -48.2 80.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.382 -0.372 . . . . 65.13 111.137 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.517 ' HG ' HG23 ' A' ' 125' ' ' ILE . 37.3 tp -60.02 -54.39 46.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.152 0.501 . . . . 71.32 111.847 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.6 mt -69.62 -34.19 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 CA-C-N 116.284 -0.416 . . . . 63.5 111.921 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.553 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 97.3 p -63.83 -47.37 81.04 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.397 -0.189 . . . . 74.55 111.437 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 24.5 t80 -59.7 -41.14 90.1 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.797 0.332 . . . . 74.42 110.833 176.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.64 -45.12 95.14 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.872 -0.68 . . . . 73.23 112.452 175.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB1' ' HG3' ' A' ' 20' ' ' GLN . . . -65.41 -34.6 78.67 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.178 0.514 . . . . 72.33 111.465 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 58.5 t80 -63.13 -48.35 78.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.895 -0.593 . . . . 74.44 111.321 175.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 101' ' ' PHE . 52.7 t -66.76 -37.36 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.622 -0.263 . . . . 75.54 110.824 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.38 -44.01 68.29 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.992 0.425 . . . . 64.42 111.428 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -55.12 -47.4 75.08 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.157 0.503 . . . . 62.11 110.956 173.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.455 ' O ' HG12 ' A' ' 112' ' ' ILE . 64.8 t60 -65.45 -34.02 77.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.181 -0.463 . . . . 74.11 111.586 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 86.7 mt -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.52 0.2 . . . . 74.21 111.084 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -59.27 -41.75 89.59 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.033 0.444 . . . . 62.41 110.479 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 61.1 m -54.05 -45.52 71.69 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.92 -0.582 . . . . 64.12 111.83 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -93.63 17.46 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 112.097 0.406 . . . . 41.31 112.097 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 71.48 6.62 5.79 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.367 0.877 . . . . 72.34 113.367 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -81.7 45.42 0.89 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.886 0.374 . . . . 74.22 111.389 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -55.54 -43.02 75.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.994 0.518 . . . . 74.42 111.573 -176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.7 p -62.38 -34.56 76.94 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.418 -0.355 . . . . 71.52 111.938 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.2 m -59.43 -26.0 64.81 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.446 0.536 . . . . 75.54 112.446 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.2 mt -53.87 -39.57 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 112.437 0.532 . . . . 62.2 112.437 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.1 -56.77 10.37 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.752 0.649 . . . . 73.12 112.752 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.3 -28.52 72.33 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 121.714 1.609 . . . . 73.54 112.289 176.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.487 ' HA ' HG13 ' A' ' 74' ' ' VAL . 6.4 tt -66.3 -46.58 76.47 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.958 0.409 . . . . 75.25 110.071 174.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.252 -0.431 . . . . 62.41 111.326 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.17 -47.06 81.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.301 -0.409 . . . . 74.53 111.079 175.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.5 m -55.81 -44.36 77.79 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 120.873 0.368 . . . . 53.42 111.23 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.517 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.9 mm -59.57 -53.5 47.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.172 0.511 . . . . 53.41 111.136 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.8 m -63.0 -36.09 82.41 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.892 -0.594 . . . . 75.55 111.584 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 28.5 t70 -61.08 -52.32 65.4 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.517 -0.31 . . . . 74.04 111.389 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 81' ' ' MET . 61.5 t -64.43 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.187 0.518 . . . . 73.51 110.972 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.544 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.5 tp -55.99 -52.85 62.71 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.765 -0.652 . . . . 71.53 111.067 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 58.7 t -76.09 -24.26 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 115.944 -0.571 . . . . 75.35 111.512 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.9 tpt180 -57.36 -45.55 84.26 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.246 0.461 . . . . 73.44 112.246 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' HD2' ' A' ' 133' ' ' LYS . 2.4 t -114.86 -30.75 6.33 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.906 1.076 . . . . 65.43 113.906 -172.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.436 ' HD2' ' C ' ' A' ' 132' ' ' THR . 13.2 mptt -116.88 29.78 7.72 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.086 0.773 . . . . 72.2 113.086 -176.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.513 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 58.2 ttp180 -60.92 -54.6 43.09 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 120.919 0.39 . . . . 75.43 111.877 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -59.68 -36.74 77.08 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.226 -0.443 . . . . 54.11 111.542 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -69.71 -36.82 76.24 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.752 0.279 . . . . 74.24 111.752 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 129' ' ' LEU . 38.2 mt -57.47 -44.97 85.3 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 111.721 0.267 . . . . 70.12 111.721 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.0 p -78.25 -43.23 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 112.364 0.505 . . . . 63.34 112.364 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -68.59 -36.74 79.12 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.834 0.679 . . . . 74.12 112.834 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -101.13 3.23 40.99 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.178 -0.327 . . . . 74.51 111.531 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 49.65 63.97 1.95 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.043 0.449 . . . . 74.55 110.574 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.09 -47.01 6.46 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 115.114 0.806 . . . . 75.2 115.114 -171.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -75.09 -20.59 59.41 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.676 0.621 . . . . 62.11 112.676 -175.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -84.44 -51.44 6.93 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.054 0.454 . . . . 75.43 110.466 170.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.568 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.91 -32.45 66.35 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.902 -0.59 . . . . 71.43 113.012 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -58.22 -39.91 80.31 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.148 0.499 . . . . 73.33 110.983 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE2' ' A' ' 39' ' ' LYS . 60.4 t -73.16 -40.46 57.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 116.12 -0.491 . . . . 60.01 111.774 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.568 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 13.7 pt-20 -73.39 -33.85 65.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 111.897 0.332 . . . . 71.24 111.897 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.53 -45.72 92.81 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 62.33 111.603 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -82.3 -9.94 59.29 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.821 0.343 . . . . 73.34 111.311 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 54.78 86.71 0.05 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.687 0.756 . . . . 73.45 111.774 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 74.8 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.24 -0.891 . . . . 74.22 111.819 -174.533 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 . . . . . 0 C--O 1.236 0.371 0 N-CA-C 110.294 -0.262 . . . . 75.01 110.294 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 -38.35 53.04 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.465 0.65 . . . . 65.55 111.055 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.436 HD21 ' CB ' ' A' ' 137' ' ' LEU . 63.3 tp -68.82 -35.79 77.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.404 -0.816 . . . . 54.41 112.13 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -69.8 -43.85 71.24 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.981 0.419 . . . . 73.24 110.175 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -59.62 -51.69 68.75 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.048 -0.524 . . . . 61.0 111.418 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -61.57 -52.2 65.41 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.73 0.3 . . . . 61.21 111.75 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.4 m -56.33 -45.48 80.32 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.684 0.278 . . . . 75.22 111.098 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.66 -41.51 95.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.701 0.286 . . . . 75.52 111.279 176.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -60.58 -48.49 81.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.039 0.447 . . . . 71.52 110.748 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.77 -54.12 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 121.109 0.48 . . . . 74.34 111.616 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.476 ' O ' HD13 ' A' ' 17' ' ' LEU . 88.8 mt -61.21 -52.02 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.034 -0.53 . . . . 71.24 111.68 -178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.8 t -53.58 -47.53 70.03 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.824 0.345 . . . . 71.43 111.197 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 11.1 mtp180 -56.2 -55.62 30.9 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.379 -0.373 . . . . 51.41 111.568 176.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -54.83 -43.78 73.32 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.674 0.274 . . . . 75.54 111.473 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.528 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.8 mp -59.95 -43.54 94.96 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.756 0.313 . . . . 64.02 111.204 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.65 -50.41 67.2 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.798 0.333 . . . . 64.14 111.619 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 25.9 mt-10 -60.44 -38.63 84.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.056 0.455 . . . . 62.21 111.388 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 29.0 mm-40 -69.83 -46.1 66.38 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.312 -0.403 . . . . 73.32 111.889 176.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.7 81.22 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.1 0.407 . . . . 71.55 112.1 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.7 p -87.45 -28.22 22.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.707 0.289 . . . . 60.4 111.77 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 C-N-CA 121.082 -0.58 . . . . 53.32 112.682 -178.658 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.771 0 N-CA-C 113.718 0.247 . . . . 72.2 113.718 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -49.21 71.15 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 111.842 0.312 . . . . 71.23 111.842 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.7 m -54.63 -46.81 73.98 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.745 0.307 . . . . 72.34 111.806 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.7 m -65.02 -35.63 81.8 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.633 0.254 . . . . 63.42 111.579 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.452 ' NH1' ' HB3' ' A' ' 42' ' ' GLU . 18.1 tpt85 -64.81 -50.47 66.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.818 0.342 . . . . 61.15 110.663 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -59.69 -43.63 93.98 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.809 -0.632 . . . . 72.42 111.35 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.14 81.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.97 0.414 . . . . 73.42 111.215 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HG ' HH21 ' A' ' 45' ' ' ARG . 49.0 tp -61.49 -36.76 81.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.277 -0.419 . . . . 63.02 111.852 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HB3' ' NH1' ' A' ' 38' ' ' ARG . 15.8 pt-20 -78.99 -37.8 38.35 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.134 -0.354 . . . . 75.45 111.137 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.526 HG23 HG21 ' A' ' 152' ' ' VAL . 95.4 m -63.12 -35.23 79.58 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.893 0.378 . . . . 74.3 110.808 175.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -56.81 -32.76 66.04 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.983 0.421 . . . . 61.31 111.161 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.439 HH21 ' HG ' ' A' ' 41' ' ' LEU . 32.2 mtt-85 -79.07 -43.72 23.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.078 0.466 . . . . 75.23 110.415 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -44.8 59.84 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.588 -0.733 . . . . 75.51 112.324 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 34.0 m -106.81 -34.49 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 112.267 0.469 . . . . 71.02 112.267 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.78 -39.64 97.73 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.28 -0.486 . . . . 61.51 113.473 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.35 -56.33 23.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.936 0.398 . . . . 74.32 110.974 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.38 -48.17 77.59 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-N 116.034 -0.53 . . . . 73.42 112.797 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.4 t -57.45 -50.86 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 O-C-N 122.851 -0.205 . . . . 75.13 111.216 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -53.84 -46.91 71.34 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.689 0.255 . . . . 72.51 111.689 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -60.86 -45.69 93.55 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.857 0.688 . . . . 71.02 112.857 -176.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -84.76 -21.2 30.08 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.692 -0.63 . . . . 54.11 112.052 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 31.2 m80 -90.4 -18.29 25.71 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.322 0.489 . . . . 74.53 112.322 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 40.6 tt0 -49.07 -46.04 43.91 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.558 0.577 . . . . 74.34 112.558 -174.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.2 t -56.17 -35.28 67.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.907 0.384 . . . . 32.42 111.965 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.57 -44.01 21.9 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.811 0.338 . . . . 72.24 111.737 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -59.9 -47.33 86.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.605 -0.27 . . . . 64.33 111.35 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.483 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 75.4 mm-40 -53.15 -38.19 62.49 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.87 0.367 . . . . 61.22 111.028 176.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.24 -41.21 86.31 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.03 -0.605 . . . . 64.44 112.313 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 39.9 mtm -72.78 -34.13 66.73 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.483 -0.422 . . . . 72.51 111.148 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.0 -33.62 73.54 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.647 0.261 . . . . 75.14 110.916 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 47.3 mtm180 -68.83 -17.3 63.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.156 0.503 . . . . 70.21 111.239 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -95.6 -20.35 19.04 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 72.24 110.917 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.6 mt -99.83 -82.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.06 -0.518 . . . . 51.11 111.865 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.7 t0 48.63 98.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.702 0.763 . . . . 63.21 111.97 -172.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.459 HD12 ' N ' ' A' ' 68' ' ' ILE . 1.6 mp -76.32 123.81 33.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 115.614 -0.721 . . . . 74.0 111.904 -175.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.25 -5.55 13.63 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.22 0.452 . . . . 52.43 112.22 177.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -167.35 174.14 8.28 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.924 0.392 . . . . 71.43 111.625 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.08 -38.91 58.79 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.434 0.531 . . . . 74.15 112.434 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -51.3 -41.79 60.74 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.241 0.459 . . . . 75.24 112.241 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.451 ' HB2' HG23 ' A' ' 68' ' ' ILE . 20.5 m-20 -63.21 -43.11 99.04 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.889 0.376 . . . . 70.4 110.647 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.527 HG21 ' HB3' ' A' ' 117' ' ' SER . 72.6 t -56.38 -43.43 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.92 -0.582 . . . . 73.35 110.993 177.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -73.07 -29.38 62.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.186 -0.461 . . . . 64.44 111.511 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.8 m -68.39 -28.67 67.31 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.933 0.397 . . . . 41.42 110.851 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 86.7 mt -55.67 -28.38 55.18 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.339 -0.391 . . . . 74.21 111.452 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 82' ' ' ILE . 81.3 p -52.13 -35.27 47.85 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 120.798 0.333 . . . . 74.12 111.373 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -61.75 -45.55 93.42 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.99 0.424 . . . . 52.45 110.713 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 82.4 t -64.16 -42.79 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.141 0.496 . . . . 74.03 110.354 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.472 ' SD ' HD12 ' A' ' 98' ' ' LEU . 21.7 mmt -56.17 -38.93 71.59 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.709 -0.678 . . . . 70.42 111.673 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 78' ' ' SER . 85.0 mt -64.37 -41.24 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.098 0.475 . . . . 74.14 110.911 174.179 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -64.73 -27.93 69.24 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.046 0.388 . . . . 65.34 112.046 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.0 t -55.28 -34.63 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 121.016 0.436 . . . . 44.33 111.911 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 CA--C 1.548 0.881 0 N-CA-C 112.057 0.392 . . . . 73.42 112.057 179.935 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.439 ' HE3' HG13 ' A' ' 95' ' ' ILE . 79.4 m95 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 120.964 0.411 . . . . 73.52 110.701 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.64 -41.36 99.83 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.311 -0.404 . . . . 71.34 112.589 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -51.77 -38.14 54.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.901 0.381 . . . . 75.02 111.636 171.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.439 HG13 ' HE3' ' A' ' 92' ' ' TRP . 36.9 mm -69.6 -43.21 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.987 0.423 . . . . 63.42 110.561 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.69 -53.19 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.199 -0.455 . . . . 74.14 111.029 175.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.9 m -57.79 -45.0 86.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.226 -0.443 . . . . 64.0 111.504 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 26.7 tp -57.33 -54.63 44.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.167 0.508 . . . . 54.24 111.631 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.84 -41.94 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.236 -0.438 . . . . 74.54 111.739 -178.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.9 m -63.02 -41.18 99.48 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.674 0.273 . . . . 53.23 111.391 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 105' ' ' VAL . 29.5 t80 -68.89 -40.15 79.36 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.681 0.277 . . . . 74.14 110.742 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.17 -48.01 83.24 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 120.834 -0.698 . . . . 23.22 112.221 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.528 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.9 -35.13 80.14 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.136 0.494 . . . . 62.2 111.374 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.416 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 44.2 t80 -61.83 -50.89 70.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.905 -0.588 . . . . 73.15 110.919 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 101' ' ' PHE . 59.3 t -62.33 -38.54 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 116.33 -0.395 . . . . 73.41 110.815 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.33 -41.01 71.89 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.871 0.367 . . . . 43.54 111.618 176.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 95.8 mttt -58.06 -44.87 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.057 0.456 . . . . 71.05 111.046 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.407 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -67.64 -36.46 80.83 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.346 -0.388 . . . . 75.54 111.163 177.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.48 -50.36 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.611 0.243 . . . . 72.53 111.556 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -60.92 -40.83 94.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.047 0.451 . . . . 63.24 110.712 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.1 m -58.81 -39.13 80.26 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.154 -0.475 . . . . 75.14 112.239 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.407 HG12 ' O ' ' A' ' 108' ' ' HIS . 38.5 pt -94.55 17.2 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.654 0.613 . . . . 71.34 112.654 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 71.74 12.59 6.28 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.747 0.647 . . . . 63.04 112.747 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -97.95 31.65 2.62 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.324 . . . . 74.14 111.347 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.446 ' HG3' HD12 ' A' ' 118' ' ' ILE . 38.4 tt0 -56.74 -35.64 68.84 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.196 0.443 . . . . 61.31 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.7 m -56.56 -27.51 57.93 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.026 0.441 . . . . 73.42 111.576 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.527 ' HB3' HG21 ' A' ' 74' ' ' VAL . 53.4 m -71.26 -25.82 62.63 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.405 0.521 . . . . 62.12 112.405 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.446 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.6 mt -53.59 -46.74 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 113.08 0.77 . . . . 75.12 113.08 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.58 -54.08 32.83 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 112.497 0.555 . . . . 63.3 112.497 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.19 -26.44 69.64 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.575 1.516 . . . . 71.4 112.492 174.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.425 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.4 tt -67.36 -44.65 78.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.717 -0.475 . . . . 74.53 109.717 173.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.466 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.16 -37.79 78.18 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.074 0.464 . . . . 71.43 111.099 174.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.14 -38.64 91.27 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.116 -0.493 . . . . 73.41 110.682 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.0 m -63.05 -44.17 96.58 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 120.815 0.341 . . . . 63.35 111.136 175.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 47.5 mm -56.34 -53.04 44.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.179 0.514 . . . . 71.01 110.656 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -63.7 -35.77 81.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.737 -0.665 . . . . 74.22 111.55 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 27.0 t70 -62.88 -52.06 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.539 -0.3 . . . . 71.35 111.396 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 65.0 t -62.23 -46.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.163 0.506 . . . . 73.35 110.442 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.7 tp -49.94 -53.07 28.53 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.526 -0.761 . . . . 65.53 111.673 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.504 HG13 ' HD3' ' A' ' 134' ' ' ARG . 71.2 t -76.92 -32.94 20.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.912 -0.586 . . . . 74.41 112.166 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 16.0 tpt180 -55.26 -33.13 62.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.008 0.432 . . . . 60.44 111.738 -176.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -40.73 3.35 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.672 0.619 . . . . 64.21 112.672 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -101.9 18.94 19.32 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.48 0.918 . . . . 71.4 113.48 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.504 ' HD3' HG13 ' A' ' 130' ' ' VAL . 14.8 tpt180 -47.28 -56.37 6.91 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.591 0.589 . . . . 73.11 112.591 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.35 -42.8 58.78 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.824 0.345 . . . . 70.43 111.069 -177.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -56.43 -37.37 70.13 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.503 -0.317 . . . . 70.22 111.824 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.558 HD11 ' HG ' ' A' ' 129' ' ' LEU . 18.4 mt -55.05 -51.17 67.16 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.421 -0.354 . . . . 72.3 111.924 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.1 p -77.78 -43.06 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.631 -0.668 . . . . 70.22 112.071 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -58.72 -40.59 84.18 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.233 0.457 . . . . 73.15 112.233 -177.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -101.66 10.85 39.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.27 0.557 . . . . 72.21 110.7 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.631 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 23.0 mtm180 67.17 7.21 5.28 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.349 -0.841 . . . . 75.02 113.088 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 137' ' ' LEU . . . 32.21 -82.65 0.0 OUTLIER Glycine 0 N--CA 1.468 0.827 0 N-CA-C 115.711 1.045 . . . . 73.14 115.711 173.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.442 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.2 m95 -70.87 -46.48 62.56 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.341 0.256 . . . . 72.43 111.382 -176.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.631 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 23.7 m-20 -61.85 -39.94 93.59 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.056 0.455 . . . . 73.1 110.025 170.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.55 91.14 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 115.85 -0.614 . . . . 63.3 112.503 176.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -67.14 -44.19 80.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.074 0.55 . . . . 64.3 111.111 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 143' ' ' TRP . 94.8 t -62.96 -44.29 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 116.199 -0.455 . . . . 64.43 111.898 178.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.58 -32.07 63.94 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.675 0.274 . . . . 71.33 111.738 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -55.82 -50.42 70.58 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.954 0.407 . . . . 71.12 111.79 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.18 -14.02 45.27 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.225 -0.443 . . . . 72.45 112.098 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 57.61 79.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.198 0.599 . . . . 72.03 111.569 -173.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.526 HG21 HG23 ' A' ' 43' ' ' THR . 93.1 t . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.858 -0.61 . . . . 70.12 110.334 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 112.633 0.605 . . . . 62.03 112.633 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.08 -40.01 60.57 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.532 0.682 . . . . 72.02 110.5 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -58.05 -38.7 76.79 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 115.487 -0.779 . . . . 71.31 111.692 176.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -67.53 -41.18 84.77 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.522 -0.308 . . . . 73.22 110.581 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -53.94 -51.45 63.78 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.769 0.318 . . . . 65.44 111.439 176.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.68 -52.73 59.35 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.056 0.391 . . . . 63.31 112.056 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -57.83 -43.17 85.64 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.283 -0.417 . . . . 73.03 111.389 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.429 HD11 ' HG2' ' A' ' 123' ' ' GLU . 36.3 tp -62.21 -41.78 98.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.55 -0.296 . . . . 64.04 111.673 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -59.25 -51.61 69.22 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.897 0.379 . . . . 64.24 111.412 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.89 -52.51 48.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.201 0.524 . . . . 74.44 111.486 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.18 -42.39 88.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.921 -0.581 . . . . 74.3 111.825 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 t -59.62 -49.59 77.18 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.63 0.252 . . . . 64.45 111.587 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.461 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 67.1 mtt180 -59.23 -48.1 82.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.871 0.367 . . . . 62.5 110.685 177.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -56.82 -54.96 40.37 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.257 -0.429 . . . . 74.11 112.055 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.34 -40.21 81.55 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.791 0.293 . . . . 74.33 111.791 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -63.47 -57.5 10.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 111.907 0.336 . . . . 74.15 111.907 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.2 mm-40 -66.66 -31.32 71.93 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.937 0.399 . . . . 72.34 111.828 -177.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -76.36 -34.48 58.92 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.632 0.253 . . . . 73.24 111.423 179.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.93 -34.54 71.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.168 0.509 . . . . 43.25 110.982 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.3 p -86.95 -22.33 25.68 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.08 -0.509 . . . . 75.43 111.794 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.665 0 C-N-CA 121.319 -0.467 . . . . 55.13 112.712 -178.842 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.888 0 N-CA-C 113.505 0.162 . . . . 55.13 113.505 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.89 -38.35 70.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.464 0.542 . . . . 54.33 112.464 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.485 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 25.1 m -58.98 -48.07 82.87 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.971 0.415 . . . . 73.03 111.82 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.4 t -64.88 -43.14 93.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.972 0.415 . . . . 70.11 111.065 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -60.84 -54.7 41.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.267 -0.424 . . . . 65.24 112.142 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.485 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 20.8 ptmt -56.03 -41.85 75.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.559 0.218 . . . . 74.01 111.054 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.05 87.77 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.766 0.317 . . . . 73.14 111.524 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.4 tp -58.85 -54.7 44.18 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.524 0.565 . . . . 64.0 112.524 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.05 -27.75 63.87 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.105 -0.372 . . . . 64.42 111.756 -176.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.492 ' O ' HG22 ' A' ' 47' ' ' VAL . 46.8 m -62.75 -45.19 93.86 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 120.827 0.346 . . . . 73.35 110.135 171.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -54.57 -34.65 62.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.29 -0.414 . . . . 73.52 111.719 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -70.73 -52.21 22.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.785 0.326 . . . . 72.41 110.945 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -58.85 -44.27 90.95 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.15 -0.477 . . . . 74.13 112.164 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 43' ' ' THR . 19.5 m -87.98 -33.05 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 120.948 0.404 . . . . 72.01 111.942 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.02 -30.34 74.0 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 114.229 0.451 . . . . 61.12 114.229 -174.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.521 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 29.6 t70 -58.42 -57.61 12.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 117.568 0.684 . . . . 75.21 111.277 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.07 -42.08 98.3 Favored Glycine 0 CA--C 1.526 0.763 0 C-N-CA 121.353 -0.451 . . . . 55.2 113.006 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 47' ' ' VAL . 77.0 t -57.52 -45.47 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 122.593 -0.357 . . . . 73.15 111.067 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -61.27 -43.86 98.19 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.76 -0.2 . . . . 72.5 111.22 175.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 4.3 mmp_? -57.25 -49.4 76.16 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.826 0.346 . . . . 75.24 111.494 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -66.17 -47.65 73.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.155 0.502 . . . . 64.2 111.637 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -73.05 -20.69 60.93 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.943 -0.571 . . . . 71.14 112.453 -176.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -49.1 -54.59 15.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.324 0.491 . . . . 74.21 112.324 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 t -53.24 -36.73 61.39 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.419 0.525 . . . . 75.33 112.419 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.08 14.81 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.014 0.435 . . . . 53.31 111.538 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -60.04 -36.57 77.57 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.342 -0.39 . . . . 73.12 111.882 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.532 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 70.7 mm-40 -47.13 -50.99 19.17 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 120.985 0.421 . . . . 53.24 111.254 176.102 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.78 -35.47 67.98 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.098 -0.501 . . . . 75.44 113.208 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 45.0 mtm -77.15 -44.59 29.75 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 122.301 -0.529 . . . . 60.24 111.143 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 105' ' ' VAL . 9.1 mp -54.88 -27.73 44.96 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.132 -0.355 . . . . 72.11 111.416 176.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 99.4 mtt180 -65.02 -44.72 88.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.749 0.309 . . . . 73.24 111.562 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.69 -7.07 55.42 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.344 0.498 . . . . 70.34 112.344 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.404 HD13 HD21 ' A' ' 77' ' ' LEU . 96.1 mt -96.35 -71.66 0.67 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.052 0.453 . . . . 74.04 111.209 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t0 47.46 88.85 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.248 -0.887 . . . . 72.32 111.838 -172.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.523 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -73.22 103.09 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.914 -0.584 . . . . 55.14 111.053 -178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.428 ' HD3' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.09 -11.3 16.66 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.101 0.408 . . . . 75.03 112.101 -179.294 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.428 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 1.2 p30 -154.42 176.79 11.91 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.024 0.44 . . . . 72.52 111.978 178.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.1 -39.72 79.36 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.163 -0.471 . . . . 74.12 112.119 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -56.1 -39.87 72.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.483 -0.326 . . . . 73.04 111.747 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.523 ' HB2' HG23 ' A' ' 68' ' ' ILE . 50.8 m-20 -62.23 -39.12 91.76 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.938 0.399 . . . . 73.41 110.711 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 82.2 t -60.87 -46.8 95.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.206 0.526 . . . . 65.35 110.927 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' SER . 99.7 mttt -65.91 -28.78 69.19 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.889 0.376 . . . . 61.14 111.186 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.9 m -67.55 -36.48 81.04 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.791 0.329 . . . . 51.12 110.492 171.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.54 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.7 mt -59.44 -39.98 85.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.668 0.27 . . . . 74.22 110.617 173.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 28.9 t -52.46 -37.02 56.07 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.96 0.409 . . . . 43.23 111.225 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -61.37 -47.27 86.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.947 0.403 . . . . 64.15 110.361 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' HG23 ' A' ' 84' ' ' VAL . 59.7 t -60.89 -42.86 94.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.263 -0.426 . . . . 75.31 110.892 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -54.54 -44.14 72.57 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.131 -0.486 . . . . 64.45 111.238 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 78' ' ' SER . 74.9 mt -61.79 -36.9 76.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.146 0.498 . . . . 64.12 111.137 176.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -71.65 -27.47 63.1 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.073 0.397 . . . . 64.53 112.073 178.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 80' ' ' VAL . 94.1 t -58.82 -23.84 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 N-CA-C 111.994 0.368 . . . . 73.25 111.994 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.469 ' CE2' HD22 ' A' ' 98' ' ' LEU . 58.0 m-85 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.437 0.532 . . . . 62.13 112.437 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.4 m95 . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.285 0.476 . . . . 74.41 112.285 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.47 -27.81 54.61 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 120.978 -0.63 . . . . 70.24 113.506 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.9 mtp85 -65.8 -25.64 67.33 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.52 -0.4 . . . . 74.44 112.0 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.4 mm -57.03 -40.75 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 121.247 0.546 . . . . 71.43 110.16 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.42 -41.45 88.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 116.031 -0.531 . . . . 64.32 110.886 176.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.6 m -57.86 -44.26 86.48 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.859 0.361 . . . . 64.04 111.233 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CE2' ' A' ' 85' ' ' PHE . 31.5 tp -61.39 -54.94 37.19 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.184 0.516 . . . . 70.11 111.693 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.37 -37.01 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.136 -0.484 . . . . 75.1 112.193 -176.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.6 p -64.05 -41.88 97.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.653 -0.249 . . . . 72.45 111.282 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 16.0 t80 -60.17 -43.48 95.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.921 0.391 . . . . 62.11 110.577 175.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.72 -46.42 92.26 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.969 -0.634 . . . . 51.31 112.552 174.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.13 80.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.941 0.401 . . . . 71.33 111.682 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -65.59 -47.98 73.9 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.267 -0.424 . . . . 70.04 111.025 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 101' ' ' PHE . 41.6 t -64.92 -34.24 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.93 0.395 . . . . 74.33 110.546 176.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.09 -39.91 79.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.134 -0.485 . . . . 65.53 111.405 176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.25 -46.2 83.26 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.15 0.5 . . . . 72.24 110.906 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -62.3 -35.8 80.14 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.988 -0.551 . . . . 71.23 110.937 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.56 HD13 ' HB2' ' A' ' 117' ' ' SER . 98.4 mt -65.29 -45.0 86.18 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.259 -0.428 . . . . 73.42 111.198 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -57.53 -43.57 84.46 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.534 0.207 . . . . 62.41 111.081 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.5 m -54.65 -48.42 72.34 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.988 0.423 . . . . 73.24 111.505 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.8 pt -90.02 17.53 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 112.159 0.429 . . . . 64.23 112.159 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 67.69 9.11 6.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.701 1.0 . . . . 72.24 113.701 174.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.52 43.56 1.12 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.83 -0.544 . . . . 61.3 111.76 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.15 -28.98 70.03 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 122.167 -0.333 . . . . 65.32 111.655 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.0 m -56.41 -27.76 57.41 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.764 0.316 . . . . 73.31 111.499 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.56 ' HB2' HD13 ' A' ' 109' ' ' LEU . 43.9 m -74.43 -26.78 60.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.107 0.41 . . . . 65.12 112.107 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.93 -45.43 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 112.994 0.739 . . . . 62.34 112.994 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.84 -51.48 19.89 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.659 0.615 . . . . 73.41 112.659 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.28 -28.69 85.38 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.638 1.559 . . . . 75.14 111.936 172.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.04 -45.02 82.93 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 109.539 -0.541 . . . . 72.15 109.539 173.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.18 82.99 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.057 0.456 . . . . 71.15 110.905 173.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.429 ' HG2' HD11 ' A' ' 10' ' ' LEU . 40.9 mt-10 -66.23 -32.56 74.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.365 -0.38 . . . . 64.51 111.013 174.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.1 m -65.01 -46.25 82.16 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.946 0.403 . . . . 64.45 110.863 175.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.419 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.1 mm -56.26 -50.76 69.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.427 0.632 . . . . 51.44 110.642 175.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.2 m -64.24 -41.2 97.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.399 -0.819 . . . . 55.22 111.748 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.1 t70 -60.65 -52.01 66.95 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.542 -0.299 . . . . 65.2 110.692 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 81' ' ' MET . 93.2 t -58.04 -44.63 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 121.113 0.482 . . . . 73.25 111.252 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 137' ' ' LEU . 14.0 tp -55.35 -51.98 65.01 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.4 0.619 . . . . 64.14 110.85 178.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 134' ' ' ARG . 90.3 t -75.5 -26.38 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.728 -0.669 . . . . 54.05 112.032 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.3 tpp180 -61.46 -35.27 77.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.924 0.392 . . . . 73.01 111.969 -176.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.7 t -121.79 -33.19 3.62 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.801 0.667 . . . . 63.11 112.801 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.515 ' HG2' HG23 ' A' ' 132' ' ' THR . 46.4 mmtm -114.72 20.53 15.17 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.262 0.838 . . . . 73.3 113.262 -172.279 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.418 ' HB2' HG13 ' A' ' 130' ' ' VAL . 44.1 ttp180 -56.41 -51.67 67.49 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.089 0.471 . . . . 71.43 111.637 177.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.66 -47.33 84.81 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.922 -0.581 . . . . 71.11 111.123 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -61.67 -37.15 83.02 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 111.611 0.226 . . . . 71.51 111.611 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 129' ' ' LEU . 20.7 mt -58.29 -48.07 81.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.645 -0.252 . . . . 73.34 111.672 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.6 p -78.34 -39.66 24.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 112.161 0.43 . . . . 74.42 112.161 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -67.03 -49.7 64.4 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.413 0.523 . . . . 73.14 112.413 -177.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -94.6 -1.35 53.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.698 0.285 . . . . 75.33 111.482 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 55.63 79.02 0.17 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.406 0.622 . . . . 75.32 111.078 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -54.47 -53.28 39.46 Favored Glycine 0 C--N 1.335 0.478 0 CA-C-N 115.244 -0.889 . . . . 64.31 114.28 -173.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -65.55 -40.03 92.38 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.132 0.466 . . . . 75.24 111.88 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 6.4 m-20 -62.2 -58.55 7.34 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.829 0.347 . . . . 75.12 110.866 175.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -59.02 -31.19 68.04 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 121.329 -0.462 . . . . 45.22 112.831 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -58.88 -55.73 31.34 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.167 0.508 . . . . 74.12 111.119 175.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.485 HG21 ' HG3' ' A' ' 39' ' ' LYS . 93.5 t -63.85 -36.83 77.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 116.147 -0.479 . . . . 64.51 111.568 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 55.1 mt-10 -66.82 -39.14 87.58 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.93 0.395 . . . . 73.34 111.236 176.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -61.32 -48.97 78.9 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.903 0.383 . . . . 73.32 111.788 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.46 -22.53 35.16 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.011 0.374 . . . . 63.44 112.011 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.1 t60 61.08 88.16 0.09 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.524 0.678 . . . . 60.3 111.044 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.476 HG21 HG23 ' A' ' 43' ' ' THR . 76.8 t . . . . . 0 N--CA 1.467 0.378 0 CA-C-N 115.717 -0.674 . . . . 62.12 110.689 178.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 108.873 -0.788 . . . . 74.52 108.873 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -61.28 -33.69 73.96 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.386 -0.821 . . . . 61.22 111.413 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.48 -35.39 75.78 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.088 0.47 . . . . 60.12 110.497 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -67.27 -36.15 81.0 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.046 -0.525 . . . . 74.23 110.24 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.488 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 4.4 mpt_? -61.98 -51.26 68.79 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.639 -0.255 . . . . 71.14 111.544 176.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.41 -48.01 83.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.018 0.437 . . . . 73.45 111.75 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 p -60.67 -52.81 63.57 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.389 -0.369 . . . . 51.24 111.344 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.9 tp -58.78 -35.96 73.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.008 0.433 . . . . 60.34 111.615 176.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 21.3 tt0 -59.27 -52.93 63.53 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.274 0.559 . . . . 75.31 110.619 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -63.85 -53.96 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 115.646 -0.707 . . . . 74.41 111.774 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.465 ' O ' HD13 ' A' ' 17' ' ' LEU . 82.8 mt -59.16 -49.85 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 112.17 0.433 . . . . 74.15 112.17 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.7 t -55.16 -50.26 69.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 120.853 0.359 . . . . 71.23 111.524 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -60.86 -42.78 98.54 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.636 -0.256 . . . . 72.1 111.593 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 85.1 t80 -58.48 -52.86 63.87 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.896 0.379 . . . . 75.42 111.765 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -54.47 -41.2 69.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.879 0.371 . . . . 60.35 111.581 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.434 ' NH2' ' HG3' ' A' ' 119' ' ' GLU . 19.4 mmt85 -65.2 -52.78 52.72 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.352 0.501 . . . . 65.23 112.352 178.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.39 -34.27 76.38 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.846 0.355 . . . . 75.13 111.955 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 33.3 mm-40 -69.64 -32.02 70.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.882 0.372 . . . . 73.11 111.208 176.253 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.52 -29.65 61.48 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.37 -0.377 . . . . 71.22 111.921 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.528 HG22 ' HE3' ' A' ' 110' ' ' LYS . 51.5 p -87.17 -30.43 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.826 0.346 . . . . 65.14 111.753 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.755 0 C-N-CA 121.26 -0.495 . . . . 72.34 112.399 -176.281 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.041 0 N-CA-C 113.93 0.332 . . . . 74.23 113.93 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.48 -50.83 69.85 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.917 0.71 . . . . 62.41 112.917 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.8 m -57.77 -50.76 72.16 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.169 0.433 . . . . 72.02 112.169 -177.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.8 p -57.78 -48.06 80.77 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.566 -0.288 . . . . 73.43 111.703 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.0 ttt-85 -52.97 -54.66 31.84 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.913 0.387 . . . . 71.44 111.288 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -55.86 -48.64 75.17 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.921 -0.582 . . . . 62.2 111.161 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.35 -41.34 98.84 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.273 -0.421 . . . . 71.22 111.829 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.24 -53.39 49.93 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 111.775 0.287 . . . . 71.51 111.775 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -64.35 -31.34 72.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.771 0.32 . . . . 72.35 111.409 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.5 ' O ' HG22 ' A' ' 47' ' ' VAL . 86.2 m -67.17 -44.15 80.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.778 0.323 . . . . 62.04 110.57 174.061 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 39.2 mt -54.9 -44.19 73.93 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.495 0.554 . . . . 64.12 112.495 178.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -72.25 -37.54 69.09 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.538 0.57 . . . . 72.23 112.538 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.411 ' NH1' HG13 ' A' ' 152' ' ' VAL . 16.1 ptm180 -73.77 -41.36 62.56 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.965 -0.46 . . . . 73.13 111.814 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 43' ' ' THR . 17.2 m -79.11 -33.51 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.189 0.518 . . . . 64.55 110.734 176.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -59.68 -50.33 68.91 Favored Glycine 0 C--O 1.225 -0.451 0 CA-C-N 115.74 -0.664 . . . . 50.25 112.751 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -53.87 -46.59 71.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.898 0.349 . . . . 73.34 111.51 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.08 -48.41 79.87 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 121.14 -0.552 . . . . 73.22 112.9 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 54' ' ' ASN . 70.9 t -63.52 -47.08 93.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.909 0.385 . . . . 73.0 111.378 176.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.5 mt-30 -55.18 -47.41 75.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.197 -0.456 . . . . 74.42 111.595 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -57.81 -42.0 83.35 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.11 0.781 . . . . 73.24 113.11 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -84.87 -27.58 26.59 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.821 -0.549 . . . . 70.32 111.906 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -90.72 -18.21 25.41 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.221 0.823 . . . . 74.41 113.221 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 31.7 tt0 -49.15 -51.12 34.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.862 0.689 . . . . 71.31 112.862 -170.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.71 -35.51 70.75 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.051 0.453 . . . . 44.4 111.655 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.05 -49.59 49.69 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.267 -0.424 . . . . 63.32 111.615 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.92 -40.8 98.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.697 0.258 . . . . 74.1 111.697 178.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.592 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 74.7 mm-40 -51.34 -44.7 62.09 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.597 0.237 . . . . 72.41 111.131 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.462 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -51.85 -38.72 46.32 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.229 -0.51 . . . . 61.24 112.826 176.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 84.9 mtp -73.3 -43.21 61.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 54.52 111.121 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.402 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 8.7 mp -57.46 -29.36 64.14 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.15 0.426 . . . . 75.23 112.15 178.392 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.592 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 53.8 mtm180 -64.51 -10.99 29.43 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.621 0.6 . . . . 74.05 112.621 -178.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -122.3 -0.74 9.29 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.009 0.433 . . . . 73.4 111.424 173.738 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.1 mt -97.12 -78.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.385 -0.37 . . . . 75.15 110.889 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 68.11 -47.93 0.53 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.161 1.171 . . . . 72.31 114.161 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.446 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.2 mp 65.58 114.82 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.7 0.8 . . . . 74.3 111.938 -177.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.54 -5.41 12.8 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.286 -0.416 . . . . 72.0 111.717 176.458 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -170.46 175.84 4.62 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.714 0.292 . . . . 65.53 111.341 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 37.8 tt0 -58.21 -24.04 57.82 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.995 0.369 . . . . 72.33 111.995 -178.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.01 -45.25 79.14 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.782 0.325 . . . . 71.33 111.016 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -63.6 -41.28 98.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.113 0.483 . . . . 65.34 110.412 175.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.0 t -56.74 -43.57 79.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 115.997 -0.547 . . . . 72.41 111.323 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 71' ' ' GLU . 65.3 mttm -60.15 -39.66 87.14 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.293 0.568 . . . . 74.1 110.564 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.1 t -66.79 -33.12 74.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.974 -0.557 . . . . 52.33 110.969 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 81' ' ' MET . 85.4 mt -61.01 -37.28 81.98 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.72 0.295 . . . . 54.12 110.798 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -52.75 -41.22 63.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.998 0.427 . . . . 72.31 111.098 177.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 79' ' ' ARG . 16.8 mmt85 -56.23 -44.58 79.7 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.164 0.507 . . . . 74.32 110.749 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.2 t -69.95 -41.08 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.782 -0.644 . . . . 70.14 111.392 178.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.463 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.5 mmt -55.54 -38.82 69.79 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.025 0.441 . . . . 71.14 111.605 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 70.9 mt -58.49 -40.72 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.248 0.547 . . . . 54.13 110.85 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.0 -25.8 60.09 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.912 -0.585 . . . . 64.45 112.47 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 94.9 t -54.0 -25.33 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-O 120.981 0.42 . . . . 75.31 111.709 175.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.614 ' HZ ' HD22 ' A' ' 98' ' ' LEU . 79.2 m-85 . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 112.474 0.546 . . . . 74.43 112.474 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.566 ' HE3' HG13 ' A' ' 95' ' ' ILE . 90.9 m95 . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 112.756 0.65 . . . . 75.14 112.756 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.24 -35.47 70.83 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 121.056 -0.592 . . . . 54.43 112.418 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -56.12 -40.49 73.83 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.865 0.466 . . . . 74.21 111.603 173.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.566 HG13 ' HE3' ' A' ' 92' ' ' TRP . 40.1 mm -67.79 -44.95 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 120.937 0.399 . . . . 73.33 110.563 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.6 t -55.06 -46.32 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 116.099 -0.5 . . . . 74.53 111.118 176.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -58.78 -46.92 86.43 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 65.32 111.597 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.614 HD22 ' HZ ' ' A' ' 85' ' ' PHE . 26.2 tp -57.76 -55.02 40.23 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.213 0.53 . . . . 75.34 111.661 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.8 mt -69.19 -35.89 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.972 -0.558 . . . . 74.23 111.912 -174.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.8 p -68.19 -43.13 78.79 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.56 0.219 . . . . 54.43 111.172 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -63.18 -42.35 99.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.775 0.321 . . . . 73.05 111.101 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.91 -48.1 84.51 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.896 -0.668 . . . . 73.34 112.158 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.427 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.41 -32.49 74.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.152 0.501 . . . . 51.14 111.353 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.466 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 39.3 t80 -63.81 -47.5 80.63 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.895 -0.593 . . . . 73.22 110.832 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.97 -36.39 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.286 -0.416 . . . . 54.3 110.515 175.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.14 -42.5 69.61 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.279 -0.418 . . . . 73.11 111.759 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -56.68 -49.11 76.06 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.438 0.637 . . . . 73.22 110.706 175.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -61.18 -33.47 73.49 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.492 -0.776 . . . . 71.32 111.07 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.35 -49.57 54.36 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.429 -0.35 . . . . 63.11 111.869 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.528 ' HE3' HG22 ' A' ' 22' ' ' THR . 63.6 tttm -64.35 -33.55 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.723 0.297 . . . . 71.14 111.183 -179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 84.0 m -54.54 -44.02 72.46 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.167 0.508 . . . . 73.24 110.944 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.2 pt -95.43 31.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 116.104 -0.498 . . . . 75.11 111.528 176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 9.3 p30 48.71 22.18 0.5 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.916 1.286 . . . . 64.31 114.224 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -93.61 35.98 1.1 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.122 0.487 . . . . 73.15 110.81 173.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -54.9 -29.17 55.3 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.093 -0.503 . . . . 74.22 112.022 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.44 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 80.6 p -58.63 -41.57 86.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.789 0.328 . . . . 75.55 111.075 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.6 t -59.17 -26.37 64.72 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 112.268 0.47 . . . . 72.01 112.268 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.6 mt -54.3 -37.77 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.478 0.547 . . . . 74.35 112.478 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 44.4 mt-10 -71.71 -52.88 7.75 Favored Pre-proline 0 CA--C 1.548 0.873 0 N-CA-C 112.418 0.525 . . . . 75.02 112.418 -176.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HD2' ' O ' ' A' ' 116' ' ' SER . 12.0 Cg_endo -57.57 -30.01 87.04 Favored 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 121.629 1.553 . . . . 65.33 111.961 172.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.45 -44.55 86.9 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.906 -0.405 . . . . 70.24 109.906 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.7 -36.61 76.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.26 -0.427 . . . . 61.03 111.104 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.11 -43.7 98.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.574 -0.285 . . . . 54.15 110.655 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -60.86 -44.78 96.57 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 120.764 0.316 . . . . 43.31 111.415 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.9 mm -55.57 -52.43 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.448 0.642 . . . . 72.41 111.094 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.1 m -67.78 -34.9 77.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.387 -0.824 . . . . 71.15 111.604 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.501 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 10.2 t70 -62.95 -52.45 62.98 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.471 -0.331 . . . . 73.21 110.709 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.463 HG21 ' HB2' ' A' ' 81' ' ' MET . 90.0 t -58.21 -35.03 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.43 0.633 . . . . 75.13 111.002 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 22.4 tp -65.24 -53.57 42.43 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.724 -0.671 . . . . 62.01 111.205 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -77.99 -29.01 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 N-CA-C 112.414 0.524 . . . . 64.43 112.414 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 20.7 tpp180 -49.21 -40.3 33.04 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 112.564 0.579 . . . . 62.13 112.564 -174.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.669 HG23 ' HD3' ' A' ' 133' ' ' LYS . 1.3 t -130.64 -25.62 2.34 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.847 0.684 . . . . 64.43 112.847 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.669 ' HD3' HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -95.6 17.55 14.62 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.65 -0.656 . . . . 73.41 111.968 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -45.41 -55.96 5.51 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.994 0.426 . . . . 75.14 111.894 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 5.3 m-20 -66.96 -50.62 61.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.223 -0.444 . . . . 63.52 111.163 -178.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -52.53 -36.74 56.11 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 111.967 0.358 . . . . 75.25 111.967 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 28.9 mt -57.58 -53.12 61.73 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.033 0.383 . . . . 72.1 112.033 177.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.5 p -77.16 -41.95 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 111.911 0.337 . . . . 71.45 111.911 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 75.4 mmtt -57.26 -49.88 74.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.995 0.426 . . . . 71.12 111.712 -179.248 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -95.17 2.42 55.02 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.016 0.376 . . . . 71.13 112.016 -177.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 57.7 mtt85 55.59 58.25 4.68 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.943 0.401 . . . . 74.53 111.382 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.3 -57.58 4.25 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 115.097 0.799 . . . . 62.33 115.097 -172.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -66.95 -26.26 66.74 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.402 0.519 . . . . 73.52 112.402 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.18 -51.22 7.68 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.871 0.367 . . . . 74.14 111.222 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.94 88.6 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 116.359 -0.382 . . . . 72.51 113.196 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -53.59 -47.38 70.19 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.109 0.481 . . . . 73.03 111.887 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.29 -46.96 95.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 116.08 -0.509 . . . . 51.13 112.007 -178.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.36 -27.15 61.33 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.08 0.4 . . . . 75.42 112.08 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -56.71 -48.99 76.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.909 0.385 . . . . 72.01 111.443 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.32 -14.83 52.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.012 0.434 . . . . 72.41 111.25 174.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 44.9 t60 68.19 85.25 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.685 0.794 . . . . 54.43 112.07 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.411 HG13 ' NH1' ' A' ' 46' ' ' ARG . 64.7 t . . . . . 0 CA--C 1.537 0.48 0 CA-C-N 115.793 -0.639 . . . . 72.14 111.247 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 120.863 0.363 . . . . 63.23 111.045 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -59.09 -30.61 68.21 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.036 0.446 . . . . 74.14 110.535 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.427 HD22 ' HB ' ' A' ' 138' ' ' VAL . 58.5 tp -61.91 -43.52 98.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.105 -0.498 . . . . 72.54 110.859 173.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -63.19 -48.58 77.73 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.335 -0.393 . . . . 74.31 110.669 178.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -58.71 -39.35 80.54 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.943 0.349 . . . . 72.33 111.943 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.405 ' NE2' ' HB2' ' A' ' 37' ' ' SER . 7.9 tp60 -63.73 -52.39 60.69 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 74.12 111.02 176.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 m -59.43 -46.09 89.71 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.024 -0.534 . . . . 72.11 111.197 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.0 tp -61.75 -38.98 89.99 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.949 -0.568 . . . . 73.44 111.476 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.44 -51.25 70.19 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.329 0.585 . . . . 65.24 110.892 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.5 mt -61.45 -54.32 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.542 -0.754 . . . . 72.22 111.597 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.409 HD13 HG22 ' A' ' 125' ' ' ILE . 75.1 mt -64.13 -46.28 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 116.031 -0.531 . . . . 71.13 112.097 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -56.99 -52.12 66.53 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.768 0.318 . . . . 74.43 111.727 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 15' ' ' ARG . 48.5 mtt180 -66.19 -32.61 74.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.727 0.269 . . . . 73.4 111.727 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -62.63 -54.66 36.24 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 122.101 -0.375 . . . . 75.54 110.849 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -55.66 -45.01 77.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.699 0.285 . . . . 74.11 111.343 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -62.64 -63.35 1.25 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.478 0.547 . . . . 71.31 112.478 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 65.2 mm-40 -58.25 -34.86 70.93 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 112.649 0.611 . . . . 74.2 112.649 -174.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -80.33 -27.55 38.36 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.9 -0.5 . . . . 71.35 111.913 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.5 -33.75 69.52 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.151 0.501 . . . . 61.44 110.874 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.8 p -87.31 -30.31 20.94 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.021 -0.536 . . . . 61.24 111.418 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.877 0 C-N-CA 121.302 -0.475 . . . . 61.14 112.644 -178.016 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.688 0 N-CA-C 114.052 0.381 . . . . 74.14 114.052 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.609 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -58.6 -51.4 70.05 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.879 0.325 . . . . 63.42 111.879 -177.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.9 m -57.86 -38.79 76.33 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.825 0.345 . . . . 62.41 111.604 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.405 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 23.0 t -65.12 -51.33 61.93 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.448 -0.342 . . . . 52.11 111.319 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -58.67 -45.97 88.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.576 -0.284 . . . . 72.43 111.592 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.609 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 18.1 mtpp -56.08 -48.32 76.32 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.936 0.398 . . . . 74.12 110.969 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.94 -43.65 98.41 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.36 -0.382 . . . . 63.52 111.447 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.9 tp -59.42 -53.32 59.57 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.158 0.429 . . . . 75.41 112.158 -179.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.91 -31.47 71.27 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.234 -0.291 . . . . 33.03 111.655 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.566 HG23 HG21 ' A' ' 152' ' ' VAL . 98.6 m -64.89 -43.01 94.3 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.814 0.34 . . . . 71.02 110.266 173.254 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.1 mt -54.12 -39.03 66.07 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.389 -0.369 . . . . 71.11 111.185 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -67.96 -45.8 73.2 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.765 0.317 . . . . 72.32 111.626 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.1 ttm-85 -61.0 -45.29 95.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.376 0.51 . . . . 71.11 112.376 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.412 ' O ' HG23 ' A' ' 51' ' ' VAL . 31.3 m -87.52 -33.74 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.073 0.463 . . . . 72.33 111.321 178.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 51' ' ' VAL . . . -69.44 -23.58 76.43 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.298 -0.477 . . . . 63.44 113.634 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.64 -53.78 34.99 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 117.183 0.492 . . . . 60.32 110.911 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.29 -44.38 28.51 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.061 -0.518 . . . . 62.04 113.017 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 47' ' ' VAL . 76.8 t -57.29 -46.06 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 112.527 0.565 . . . . 73.33 112.527 -176.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -57.31 -44.2 83.95 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 122.11 -0.369 . . . . 73.34 111.274 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -67.42 -54.11 23.21 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.47 0.545 . . . . 74.4 112.47 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -70.58 -20.06 62.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.208 0.447 . . . . 74.41 112.208 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 66.7 m80 -90.3 -26.23 20.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.269 -0.269 . . . . 64.14 111.468 171.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.599 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 35.4 tt0 -53.08 -55.43 23.96 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.87 0.367 . . . . 70.24 111.518 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -56.4 -28.18 58.56 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.225 -0.443 . . . . 62.32 111.902 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.5 -44.63 20.86 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.904 0.383 . . . . 72.02 111.556 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.8 m-85 -70.8 -22.82 62.31 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.822 0.305 . . . . 65.35 111.822 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.448 ' NE2' ' HZ ' ' A' ' 104' ' ' PHE . 69.9 mm-40 -49.29 -35.88 19.28 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.966 0.412 . . . . 75.52 111.38 174.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.23 -30.43 70.83 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 121.267 -0.492 . . . . 60.42 112.988 177.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 72.8 mtm -89.11 -47.35 8.16 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.463 -0.433 . . . . 70.02 111.696 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.543 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 9.7 mp -56.85 -34.04 67.41 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.981 -0.449 . . . . 75.0 112.168 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -63.3 -17.42 62.52 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 120.831 0.348 . . . . 73.14 111.808 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -113.92 1.67 14.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.718 0.294 . . . . 72.42 111.145 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 63' ' ' LEU . 91.2 mt -102.94 -73.97 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.516 0.327 . . . . 64.04 111.286 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 40.95 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.79 -0.641 . . . . 72.53 112.065 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.504 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.7 mp -59.6 104.99 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.715 -0.675 . . . . 64.32 112.161 -173.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.54 -4.99 15.21 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.757 -0.656 . . . . 52.24 112.173 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -159.04 169.57 23.99 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.02 0.438 . . . . 43.03 111.798 173.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.67 -36.72 69.91 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.732 0.641 . . . . 73.41 112.732 -175.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -55.19 -35.05 64.41 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 111.689 0.255 . . . . 74.45 111.689 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.497 ' HB3' HG13 ' A' ' 68' ' ' ILE . 67.6 m-20 -62.56 -42.69 99.7 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.904 0.383 . . . . 71.23 110.81 176.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.9 t -60.81 -43.05 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.171 0.51 . . . . 74.23 110.637 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -65.78 -29.47 69.97 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.227 -0.442 . . . . 74.31 111.112 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.5 m -68.42 -37.71 80.56 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.83 0.348 . . . . 75.15 110.586 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.519 ' O ' ' HG2' ' A' ' 81' ' ' MET . 98.5 mt -58.45 -33.14 69.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.36 -0.382 . . . . 64.43 111.194 175.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -52.27 -41.4 62.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.857 0.36 . . . . 71.42 111.591 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.62 -37.47 84.08 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.396 -0.366 . . . . 72.15 111.614 178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.61 -41.65 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.976 0.417 . . . . 45.43 110.942 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.3 mmt -55.02 -42.75 72.99 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.016 -0.538 . . . . 54.43 111.487 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 82.0 mt -58.54 -40.96 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.201 -0.454 . . . . 72.51 111.237 175.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -67.98 -26.83 66.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.18 0.437 . . . . 74.41 112.18 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.526 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 62.1 t -56.7 -25.37 21.39 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.149 0.499 . . . . 61.13 110.993 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.3 m-85 . . . . . 0 CA--C 1.541 0.606 0 N-CA-C 112.808 0.67 . . . . 70.52 112.808 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.539 ' HE3' HG13 ' A' ' 95' ' ' ILE . 93.4 m95 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 112.147 0.425 . . . . 73.53 112.147 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.42 -24.83 56.87 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.461 -0.4 . . . . 50.54 113.296 177.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.568 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 2.8 mmp_? -67.26 -33.04 74.47 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.462 -0.434 . . . . 75.54 111.255 176.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.539 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.1 mm -63.8 -46.11 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.303 0.573 . . . . 62.21 109.669 173.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -57.59 -44.43 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.704 -0.68 . . . . 64.44 110.904 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.0 m -61.57 -44.85 96.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.324 -0.398 . . . . 72.31 111.259 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.586 ' HG ' HG23 ' A' ' 125' ' ' ILE . 41.9 tp -58.49 -54.92 41.65 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.236 0.541 . . . . 71.11 111.209 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.2 mt -65.65 -32.58 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 115.98 -0.555 . . . . 74.22 111.221 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -64.36 -48.46 75.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 116.503 -0.317 . . . . 75.33 111.449 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 105' ' ' VAL . 14.3 t80 -61.39 -43.13 99.39 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.84 0.353 . . . . 74.33 110.582 177.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.73 -44.51 95.74 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 120.932 -0.652 . . . . 73.45 112.481 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.36 94.22 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.689 0.28 . . . . 44.25 111.484 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 16.0 t80 -64.83 -45.53 85.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.805 0.336 . . . . 74.32 111.429 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.557 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.7 t -64.42 -37.94 81.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 121.973 -0.454 . . . . 74.14 110.023 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . 0.403 ' HA ' HD12 ' A' ' 109' ' ' LEU . . . -61.15 -50.69 72.16 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.338 0.496 . . . . 74.34 112.338 179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.69 -35.59 76.67 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.15 -0.344 . . . . 73.1 111.004 178.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.432 ' O ' HG12 ' A' ' 112' ' ' ILE . 86.6 t60 -68.05 -35.28 77.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.751 0.31 . . . . 70.52 110.627 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 85.7 mt -60.77 -49.47 77.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.654 -0.248 . . . . 73.12 111.057 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -62.79 -38.19 89.68 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.789 0.328 . . . . 71.43 110.93 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 99.6 m -53.6 -38.33 63.88 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.126 0.489 . . . . 73.02 111.084 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -103.59 19.5 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 116.361 -0.382 . . . . 72.41 111.921 177.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 57.03 59.17 3.57 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.324 0.583 . . . . 70.24 112.396 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -131.17 33.89 4.08 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.915 -0.584 . . . . 74.21 110.984 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.77 -33.23 66.41 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.518 0.562 . . . . 74.31 112.518 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.0 m -54.98 -27.28 42.78 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 120.791 0.329 . . . . 74.51 111.606 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.0 t -79.18 -27.18 42.61 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.022 0.379 . . . . 42.4 112.022 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.64 -45.14 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 112.807 0.669 . . . . 65.03 112.807 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.76 -53.32 44.44 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 112.712 0.634 . . . . 65.42 112.712 -176.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.34 -27.23 82.74 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 121.598 1.532 . . . . 61.51 112.216 174.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -66.08 -44.43 84.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.362 -0.607 . . . . 74.43 109.362 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.11 -37.85 81.24 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.134 -0.485 . . . . 60.51 110.842 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.85 -40.03 93.91 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.221 -0.445 . . . . 64.45 110.79 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 61.6 m -62.96 -45.42 92.51 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.787 0.327 . . . . 73.2 111.246 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.586 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.7 -52.31 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 121.5 0.667 . . . . 74.35 110.669 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.404 ' OG1' HD12 ' A' ' 13' ' ' ILE . 25.4 m -68.24 -33.46 74.43 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.225 -0.898 . . . . 61.44 111.582 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 31.1 t70 -65.05 -51.97 58.47 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.744 -0.207 . . . . 75.42 111.282 -176.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 89.3 t -59.8 -41.92 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.275 0.56 . . . . 63.4 110.549 176.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 55.0 tp -55.97 -53.34 58.13 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.51 -0.768 . . . . 60.24 111.611 176.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 68.8 t -75.25 -26.52 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 115.902 -0.59 . . . . 73.53 111.843 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 18.7 tpt180 -57.31 -37.32 72.31 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.005 0.372 . . . . 72.53 112.005 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.595 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.7 t -125.07 -38.68 2.3 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.82 0.674 . . . . 63.13 112.82 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.595 ' HG2' HG23 ' A' ' 132' ' ' THR . 33.0 mmtp -105.04 20.01 19.61 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.767 0.654 . . . . 53.34 112.767 -173.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 46.6 ttp180 -54.68 -54.27 43.96 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.232 0.539 . . . . 65.12 111.365 176.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -53.25 -44.81 68.43 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.533 -0.758 . . . . 72.41 111.659 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -62.38 -38.22 88.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 111.776 0.287 . . . . 72.11 111.776 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.9 mt -56.44 -50.07 72.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.614 0.245 . . . . 72.43 111.605 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.427 ' HB ' HD22 ' A' ' 5' ' ' LEU . 8.1 p -77.19 -43.46 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 112.101 0.408 . . . . 62.41 112.101 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -62.36 -60.34 3.69 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.962 0.411 . . . . 71.12 111.808 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -81.97 -2.99 53.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.606 -0.27 . . . . 72.3 111.648 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 70.9 mtt180 57.14 61.76 2.45 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.181 -0.463 . . . . 71.24 110.836 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -51.21 -45.1 52.29 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.703 -0.68 . . . . 74.01 114.635 -173.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -72.85 -23.81 60.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.363 0.581 . . . . 74.12 111.786 -176.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -81.74 -47.37 13.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.301 0.572 . . . . 75.12 110.215 173.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.425 ' HA2' ' CG ' ' A' ' 148' ' ' GLU . . . -62.84 -30.71 77.99 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.778 -0.646 . . . . 15.31 113.369 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -58.76 -40.56 84.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.997 0.427 . . . . 64.14 111.58 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 48.6 t -73.57 -41.75 55.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.307 -0.406 . . . . 74.11 112.056 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.425 ' CG ' ' HA2' ' A' ' 145' ' ' GLY . 0.0 OUTLIER -73.39 -31.63 64.0 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.714 0.635 . . . . 61.22 112.714 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.04 -48.72 80.57 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.036 0.446 . . . . 70.54 111.487 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -83.8 -15.08 49.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.324 -0.398 . . . . 73.05 111.387 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 76.3 t60 55.77 68.24 0.89 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.593 0.711 . . . . 64.45 111.114 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.566 HG21 HG23 ' A' ' 43' ' ' THR . 69.5 t . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 115.632 -0.713 . . . . 71.32 112.631 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 CA--C 1.542 0.655 0 CA-C-O 120.999 0.428 . . . . 62.44 111.959 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -63.69 -45.55 89.55 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.492 -0.322 . . . . 70.54 111.839 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.1 tp -61.02 -39.9 91.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.022 0.439 . . . . 75.41 111.146 -178.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -59.25 -47.91 83.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.202 -0.454 . . . . 75.23 110.951 174.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -44.36 94.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 111.939 0.348 . . . . 72.02 111.939 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -56.57 -52.44 64.8 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.256 0.551 . . . . 73.33 110.736 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.9 m -61.85 -43.78 98.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.775 -0.648 . . . . 75.13 111.261 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.1 -46.71 85.07 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.284 -0.416 . . . . 75.35 111.544 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -58.07 -51.17 70.79 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.935 0.398 . . . . 73.42 111.151 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.5 mt -58.62 -50.67 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.004 0.43 . . . . 74.1 111.672 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.464 HD13 HG22 ' A' ' 125' ' ' ILE . 84.7 mt -65.94 -48.77 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.217 -0.447 . . . . 63.24 111.818 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -55.34 -46.61 76.39 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.891 0.377 . . . . 71.35 110.845 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.611 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 3.3 mtt85 -53.86 -57.07 12.29 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.15 -0.477 . . . . 73.51 111.285 174.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -53.84 -45.33 70.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.394 0.516 . . . . 72.3 112.394 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.23 -45.77 87.1 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.826 0.346 . . . . 75.41 111.292 177.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.7 mmm180 -61.49 -48.34 81.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.894 0.378 . . . . 74.33 111.296 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 18.6 mm-40 -56.15 -51.63 67.29 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.129 0.49 . . . . 74.5 111.803 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -70.92 -36.25 72.59 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.161 -0.472 . . . . 73.22 112.094 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.5 72.83 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.043 0.386 . . . . 60.2 112.043 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.5 p -95.2 -17.06 22.06 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.338 0.496 . . . . 74.33 112.338 -178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 121.228 -0.511 . . . . 60.3 113.236 179.909 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.036 0 N-CA-C 114.265 0.466 . . . . 62.45 114.265 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.9 -49.66 72.8 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.635 0.976 . . . . 63.31 113.635 -172.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.5 m -56.33 -46.23 80.02 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.949 0.351 . . . . 75.14 111.949 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.2 p -63.67 -44.43 93.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.892 0.377 . . . . 73.24 111.302 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.8 mtp180 -63.67 -54.04 41.9 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.1 0.408 . . . . 75.42 112.1 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 0.2 OUTLIER -56.75 -37.93 71.72 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.814 0.34 . . . . 71.44 110.879 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.29 72.98 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.857 0.361 . . . . 73.13 111.445 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.414 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 44.2 tp -63.96 -44.93 91.28 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.423 -0.353 . . . . 65.42 111.828 -178.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.25 -34.49 78.12 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 122.181 -0.324 . . . . 74.3 110.677 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.575 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.7 m -61.22 -46.58 89.85 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.738 0.304 . . . . 51.13 110.385 172.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -53.99 -31.64 51.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.441 -0.345 . . . . 72.43 111.673 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 41' ' ' LEU . 65.3 mtt-85 -72.64 -54.88 7.84 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 122.031 -0.418 . . . . 74.11 111.272 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.434 ' NH1' HG13 ' A' ' 152' ' ' VAL . 15.8 ptm180 -63.69 -43.87 95.36 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.502 0.556 . . . . 75.41 112.502 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.575 HG22 ' O ' ' A' ' 43' ' ' THR . 10.7 m -87.23 -33.63 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 122.119 -0.363 . . . . 72.53 111.824 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.42 -48.33 58.22 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 120.831 -0.7 . . . . 72.42 112.808 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.0 t70 -57.27 -52.28 65.95 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.912 0.387 . . . . 71.31 110.719 176.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.21 -52.1 46.26 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 121.189 -0.529 . . . . 54.22 112.857 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.443 HG21 HG11 ' A' ' 96' ' ' VAL . 63.4 t -58.04 -43.43 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 111.726 0.269 . . . . 73.13 111.726 178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.541 ' NE2' ' HE3' ' A' ' 107' ' ' LYS . 50.0 mt-30 -55.73 -45.77 77.91 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.65 0.262 . . . . 60.54 111.52 177.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 53.2 mtp85 -66.81 -37.73 85.1 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.729 0.64 . . . . 74.02 112.729 -173.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.87 -22.15 27.67 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.592 -0.693 . . . . 73.25 112.142 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.412 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 0.6 OUTLIER -86.43 -21.87 26.86 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.161 -0.337 . . . . 63.33 111.775 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.92 -48.46 60.69 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.414 0.524 . . . . 72.33 112.414 -176.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.7 t -56.3 -28.4 58.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.135 0.493 . . . . 75.41 112.079 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.57 -38.32 23.85 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.948 0.404 . . . . 61.31 111.718 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 18.3 m-85 -76.23 -33.16 59.21 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.624 0.601 . . . . 71.52 112.624 -176.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 63.5 mm-40 -46.29 -56.52 5.67 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.603 0.594 . . . . 72.22 112.603 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.99 -22.65 58.12 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 121.367 -0.444 . . . . 44.42 114.139 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.556 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 26.4 mtm -87.4 -36.54 17.7 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 122.032 -0.687 . . . . 72.24 109.44 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.3 tp -60.1 -33.1 71.65 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.522 -0.763 . . . . 62.41 110.953 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 54.3 mtt85 -65.47 -42.78 91.89 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.741 -0.663 . . . . 74.42 112.056 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -77.1 -15.64 59.49 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.786 0.326 . . . . 75.1 110.781 177.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 62' ' ' MET . 95.8 mt -81.95 -80.82 0.15 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.342 -0.39 . . . . 61.24 111.27 175.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.2 t70 45.24 90.44 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.34 0.656 . . . . 61.23 111.647 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.536 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.8 mp -68.55 102.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.244 0.545 . . . . 55.54 111.619 -175.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -12.03 27.81 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.128 -0.487 . . . . 70.35 111.892 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.6 p-10 -163.0 175.16 11.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.043 0.449 . . . . 63.34 112.02 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -50.83 -36.99 40.31 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.881 -0.6 . . . . 70.55 112.494 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.544 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 37.7 t70 -56.87 -39.71 74.85 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 111.879 0.325 . . . . 73.24 111.879 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.529 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.0 m-20 -63.18 -36.07 82.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.883 0.373 . . . . 65.13 110.814 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.13 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.075 0.464 . . . . 65.3 110.511 175.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 9.6 mtmp? -63.96 -29.94 71.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.009 0.433 . . . . 75.31 110.821 175.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -67.57 -40.47 84.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.016 0.436 . . . . 64.32 110.618 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.1 mt -58.78 -34.73 71.77 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.402 -0.363 . . . . 71.24 111.211 176.335 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 47.0 m -52.16 -37.75 55.52 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.941 0.4 . . . . 65.22 110.945 176.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.499 ' HD3' HD12 ' A' ' 82' ' ' ILE . 31.0 mmt180 -64.07 -48.87 74.54 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.315 -0.402 . . . . 75.31 111.399 175.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 84' ' ' VAL . 86.8 t -55.29 -40.99 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.116 0.484 . . . . 61.14 110.489 175.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.522 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.2 mmt -60.79 -38.57 85.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.85 -0.614 . . . . 72.2 111.436 177.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.499 HD12 ' HD3' ' A' ' 79' ' ' ARG . 85.5 mt -61.32 -38.36 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-O 121.027 0.442 . . . . 72.55 110.623 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -68.8 -28.8 67.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.383 -0.371 . . . . 74.31 111.47 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 80' ' ' VAL . 95.1 t -61.37 -34.48 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.919 0.39 . . . . 75.33 111.183 174.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.517 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 22.8 m-85 . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 112.012 0.375 . . . . 75.32 112.012 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.535 ' HE3' HG13 ' A' ' 95' ' ' ILE . 95.9 m95 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 112.761 0.652 . . . . 74.14 112.761 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.05 -25.06 53.08 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 121.228 -0.51 . . . . 60.21 112.86 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -70.57 -35.58 73.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.519 -0.401 . . . . 71.51 111.046 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.535 HG13 ' HE3' ' A' ' 92' ' ' TRP . 45.3 mm -62.73 -45.31 99.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.31 0.576 . . . . 72.41 110.037 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.443 HG11 HG21 ' A' ' 51' ' ' VAL . 43.5 t -56.02 -47.4 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 115.657 -0.702 . . . . 63.33 110.75 174.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 94.3 m -55.13 -44.14 74.79 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.537 -0.301 . . . . 54.21 111.517 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 125' ' ' ILE . 22.2 tp -58.46 -55.67 32.07 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.396 0.617 . . . . 65.31 111.648 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 55.8 mt -71.09 -32.56 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.784 -0.644 . . . . 64.53 111.317 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.4 t -61.6 -52.05 66.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.892 -0.594 . . . . 74.43 111.244 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.497 ' O ' HG23 ' A' ' 105' ' ' VAL . 23.4 t80 -63.95 -35.99 82.48 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.692 0.282 . . . . 75.21 110.87 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.08 -48.67 84.95 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 120.985 -0.626 . . . . 72.01 112.574 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.46 83.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.859 0.361 . . . . 74.51 111.348 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.471 ' CE2' HD22 ' A' ' 63' ' ' LEU . 78.3 t80 -60.72 -46.65 89.59 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.387 -0.369 . . . . 74.11 111.232 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 101' ' ' PHE . 58.0 t -64.88 -37.33 79.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 120.908 0.385 . . . . 74.12 110.512 175.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.73 -39.22 70.83 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.112 -0.495 . . . . 75.25 111.496 176.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.541 ' HE3' ' NE2' ' A' ' 52' ' ' GLN . 94.9 mttt -56.08 -49.27 74.26 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.359 0.6 . . . . 72.32 110.653 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.524 ' O ' HG12 ' A' ' 112' ' ' ILE . 58.3 t60 -63.35 -41.9 98.89 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.725 -0.671 . . . . 73.33 111.016 -179.15 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.536 HD21 ' HB ' ' A' ' 68' ' ' ILE . 88.5 mt -63.11 -49.96 72.4 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.062 0.458 . . . . 75.51 111.451 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -59.67 -30.26 68.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.667 -0.697 . . . . 75.53 110.63 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.5 m -77.31 -48.75 16.58 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.008 -0.542 . . . . 70.53 112.246 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 108' ' ' HIS . 42.2 pt -83.79 24.32 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 112.681 0.623 . . . . 73.33 112.681 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 62.4 18.09 10.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.549 0.574 . . . . 61.14 112.549 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -102.88 31.41 4.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.24 0.543 . . . . 62.51 110.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.26 -33.58 67.75 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.675 -0.693 . . . . 52.2 112.386 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 62.3 m -56.34 -32.75 64.98 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 120.886 0.374 . . . . 61.4 111.772 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.461 ' HB2' HD13 ' A' ' 109' ' ' LEU . 48.2 m -62.29 -26.76 68.59 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.223 0.453 . . . . 65.42 112.223 -179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.27 -44.22 74.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.849 0.685 . . . . 53.31 112.849 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -64.04 -53.76 45.66 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 112.52 0.563 . . . . 63.5 112.52 -175.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.34 -28.05 71.77 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.833 1.689 . . . . 73.35 112.276 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.2 tt -61.86 -40.68 96.22 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.99 0.424 . . . . 72.23 109.994 175.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.76 -33.83 73.53 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.239 -0.437 . . . . 75.13 111.233 175.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.344 -0.389 . . . . 63.12 110.908 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.8 m -59.01 -45.33 90.96 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.956 0.408 . . . . 33.32 111.276 175.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.549 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.5 mm -57.27 -53.17 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.213 0.53 . . . . 65.21 111.09 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 36.7 m -65.55 -38.52 89.83 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.798 -0.637 . . . . 61.05 111.91 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 29.5 t70 -59.39 -51.83 68.22 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.602 0.239 . . . . 62.12 111.226 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.522 HG21 ' HB2' ' A' ' 81' ' ' MET . 67.8 t -63.9 -39.62 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.928 0.394 . . . . 71.11 111.086 178.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.443 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -55.63 -52.47 63.7 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.324 0.583 . . . . 73.0 110.902 176.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 95.0 t -72.76 -30.44 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.806 -0.633 . . . . 71.31 111.633 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 2.0 tpt180 -57.36 -30.26 64.7 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.116 0.413 . . . . 74.11 112.116 -175.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.638 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.1 OUTLIER -130.18 -30.78 1.93 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.451 0.908 . . . . 72.23 113.451 -176.887 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.638 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.4 mptp? -112.36 23.83 13.2 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.425 -0.797 . . . . 73.33 113.007 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 16.2 ttp180 -53.85 -65.39 0.58 Allowed 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.666 0.746 . . . . 52.4 112.187 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.93 -31.6 71.94 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.154 -0.93 . . . . 61.42 111.097 -173.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -68.6 -35.82 77.87 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.404 -0.362 . . . . 62.55 111.621 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.56 ' HB2' HD21 ' A' ' 5' ' ' LEU . 52.6 mt -54.64 -45.6 73.82 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 120.555 0.217 . . . . 72.24 111.534 175.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.3 p -78.88 -43.78 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 112.329 0.492 . . . . 51.12 112.329 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -60.87 -57.76 11.29 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.128 0.489 . . . . 73.24 112.167 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -87.61 1.41 53.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.5 -0.318 . . . . 71.44 111.514 -177.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 58.15 62.2 2.1 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.306 -0.406 . . . . 72.14 110.507 -178.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 146' ' ' PHE . . . -42.85 -52.56 5.58 Favored Glycine 0 C--O 1.223 -0.545 0 CA-C-N 115.689 -0.687 . . . . 74.15 114.319 -174.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -72.04 -21.06 61.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.439 0.533 . . . . 74.0 112.439 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -84.82 -58.22 2.8 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.1 0.476 . . . . 71.34 110.66 174.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.573 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -56.84 -32.04 61.65 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 115.978 -0.555 . . . . 61.3 113.112 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 142' ' ' GLY . 80.3 t80 -54.88 -39.26 68.51 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.317 0.58 . . . . 63.35 111.14 174.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.544 HG21 ' HG3' ' A' ' 39' ' ' LYS . 96.2 t -73.51 -43.2 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 115.721 -0.672 . . . . 74.0 112.263 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.573 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 10.0 pt-20 -73.31 -33.75 65.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 111.934 0.346 . . . . 53.12 111.934 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -56.66 -48.2 78.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.1 0.476 . . . . 73.13 111.232 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.49 -5.35 59.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 72.35 111.688 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 60.74 50.44 5.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.546 0.689 . . . . 74.44 111.917 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.465 HG21 ' OG1' ' A' ' 43' ' ' THR . 97.4 t . . . . . 0 CA--C 1.54 0.574 0 CA-C-N 115.468 -0.787 . . . . 74.23 112.171 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' A' ' 6' ' ' TYR . 19.4 t70 . . . . . 0 CA--C 1.545 0.776 0 CA-C-O 120.456 0.169 . . . . 70.35 111.287 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.71 -46.03 81.49 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.242 0.544 . . . . 74.41 111.496 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 137' ' ' LEU . 59.8 tp -68.96 -33.5 73.8 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.218 -0.447 . . . . 62.45 110.69 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.411 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 6.6 t80 -59.88 -47.19 86.78 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.246 -0.434 . . . . 64.41 109.954 174.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -57.04 -49.64 75.21 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.965 0.358 . . . . 73.03 111.965 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 60.6 tt0 -62.53 -48.17 80.72 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.426 0.631 . . . . 63.1 111.475 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 m -59.86 -32.09 70.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.117 0.484 . . . . 54.2 110.751 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -72.75 -46.22 54.55 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.131 -0.486 . . . . 73.34 111.865 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 8' ' ' GLN . 14.1 pt-20 -57.59 -43.07 84.33 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.965 0.412 . . . . 63.24 110.765 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 67.1 mt -65.15 -54.7 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 116.053 -0.521 . . . . 61.22 111.895 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 125' ' ' ILE . 76.5 mt -66.4 -51.16 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.836 0.35 . . . . 72.13 111.857 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.511 ' HA ' ' HB1' ' A' ' 122' ' ' ALA . 47.7 t -50.04 -51.27 43.55 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.229 -0.441 . . . . 72.42 111.559 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 28.0 mtp180 -58.75 -45.99 88.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 120.853 -0.339 . . . . 74.1 111.517 176.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -53.43 -44.18 68.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.882 0.327 . . . . 64.35 111.882 -176.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -62.22 -42.65 99.5 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.815 -0.175 . . . . 63.42 111.348 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.554 ' NH2' ' HG2' ' A' ' 119' ' ' GLU . 8.4 mpt_? -61.55 -48.26 81.79 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.689 0.28 . . . . 63.11 111.34 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 16.1 mm-40 -54.45 -46.81 73.36 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.415 0.626 . . . . 65.32 111.062 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.688 ' HG3' ' HE2' ' A' ' 107' ' ' LYS . 8.6 tp-100 -75.64 -43.05 49.75 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.761 -0.654 . . . . 73.33 112.369 -175.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.27 80.38 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.251 0.463 . . . . 61.43 112.251 -177.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.8 p -87.02 -28.62 22.51 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.799 0.333 . . . . 55.4 111.644 -177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.61 0 C-N-CA 121.213 -0.517 . . . . 72.11 112.875 179.924 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.892 0 N-CA-C 113.783 0.273 . . . . 75.11 113.783 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.88 -50.13 61.6 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.862 0.69 . . . . 72.01 112.862 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.531 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 90.5 m -64.3 -40.48 96.02 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.866 0.365 . . . . 75.13 111.635 -177.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.2 m -66.06 -42.19 89.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.712 0.291 . . . . 43.53 111.453 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -68.87 -52.77 26.14 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.627 0.251 . . . . 74.41 111.335 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HB2' HG11 ' A' ' 147' ' ' VAL . 20.6 ptmt -54.97 -39.49 69.03 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.958 0.409 . . . . 62.55 110.556 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.1 -53.2 33.05 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.261 -0.427 . . . . 74.33 111.706 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.559 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.0 tp -59.55 -40.51 87.49 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.521 0.563 . . . . 75.3 112.521 -176.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 12.3 pt-20 -73.4 -41.39 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.273 -0.267 . . . . 75.24 111.442 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.453 ' O ' HG22 ' A' ' 47' ' ' VAL . 82.7 m -69.26 -34.34 74.63 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 122.097 -0.377 . . . . 65.01 111.275 178.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -56.51 -44.05 80.37 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.883 0.327 . . . . 60.4 111.883 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.559 HH21 ' HG ' ' A' ' 41' ' ' LEU . 19.2 ptp180 -78.61 -32.38 47.47 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.996 0.427 . . . . 65.32 110.962 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.446 HH11 ' HD2' ' A' ' 46' ' ' ARG . 20.8 ttt180 -58.62 -44.88 90.11 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.061 -0.518 . . . . 75.22 111.759 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 43' ' ' THR . 32.8 m -91.66 -33.11 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.014 0.435 . . . . 74.25 111.223 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.46 -32.55 73.25 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 116.167 -0.47 . . . . 61.21 113.759 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.6 t70 -53.44 -56.65 15.08 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 117.088 0.444 . . . . 74.53 110.875 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.9 -43.79 81.63 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 121.018 -0.61 . . . . 32.31 113.066 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 47' ' ' VAL . 69.7 t -57.34 -46.06 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 112.039 0.385 . . . . 74.43 112.039 -178.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.468 HE22 ' HG2' ' A' ' 20' ' ' GLN . 57.3 mt-30 -63.12 -28.07 69.82 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.878 0.325 . . . . 75.13 111.878 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 46.9 mtt180 -69.29 -52.67 25.17 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 74.41 111.422 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -74.47 -23.06 58.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.824 0.345 . . . . 73.3 111.791 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.422 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 0.3 OUTLIER -82.66 -22.63 34.55 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.593 0.22 . . . . 72.34 111.593 173.351 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 43.1 tt0 -50.71 -56.6 11.21 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.102 0.408 . . . . 74.03 112.102 -176.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.4 t -54.89 -37.9 66.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.208 0.447 . . . . 72.2 112.208 -178.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.51 -46.04 50.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.893 0.378 . . . . 70.24 111.61 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.1 m-30 -64.63 -40.22 95.07 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.307 -0.406 . . . . 72.43 111.776 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.607 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 76.4 mm-40 -44.97 -55.07 5.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 120.779 0.323 . . . . 74.15 111.446 177.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.53 -34.76 49.99 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 116.154 -0.476 . . . . 64.33 113.961 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.8 mtm -79.46 -44.18 21.83 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.15 -0.618 . . . . 63.34 111.256 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.84 -32.81 69.75 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 111.665 0.246 . . . . 71.44 111.665 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 79.5 mtp180 -59.99 -34.87 73.91 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.364 0.602 . . . . 70.44 111.34 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -84.01 -38.88 20.36 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.95 -0.568 . . . . 62.21 111.153 177.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 77' ' ' LEU . 83.9 mt -69.56 -76.72 0.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.971 -0.559 . . . . 75.01 111.823 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 t70 43.67 85.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.312 0.577 . . . . 74.32 111.281 -172.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.7 mp -60.23 106.66 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 115.834 -0.621 . . . . 35.24 111.852 -174.028 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.77 -5.88 20.83 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.183 0.438 . . . . 71.42 112.183 -179.838 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -162.92 173.71 13.32 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.808 0.337 . . . . 64.42 111.865 174.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.28 -35.99 65.64 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.012 0.434 . . . . 53.4 111.907 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -51.55 -41.7 61.28 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.186 -0.461 . . . . 65.33 112.004 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.52 ' HB2' HG23 ' A' ' 68' ' ' ILE . 42.6 m-20 -60.47 -41.19 93.67 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.686 0.279 . . . . 73.54 111.285 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.24 -42.75 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.276 0.56 . . . . 70.21 110.936 178.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.02 -28.58 65.6 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.132 -0.485 . . . . 75.34 111.195 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -68.45 -37.31 80.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.168 0.508 . . . . 73.12 110.252 171.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 81' ' ' MET . 95.5 mt -60.43 -38.89 85.52 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.172 -0.467 . . . . 53.33 110.771 174.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.433 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.8 t -52.68 -37.92 59.67 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.121 0.486 . . . . 75.23 111.137 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -65.58 -40.33 92.6 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.514 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.93 -40.41 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.946 0.403 . . . . 72.03 110.896 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.5 mmt -57.17 -36.59 70.96 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.213 0.53 . . . . 72.42 110.759 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -62.08 -40.69 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 115.988 -0.551 . . . . 65.21 110.931 172.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -65.0 -32.6 74.41 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.007 0.373 . . . . 64.43 112.007 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.6 t -54.62 -41.21 54.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.027 0.441 . . . . 61.23 111.609 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 50.8 m-85 . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 112.016 0.376 . . . . 75.15 112.016 178.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 19.3 m95 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.993 0.425 . . . . 73.42 111.166 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.75 -29.07 71.15 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 121.04 -0.6 . . . . 33.41 112.832 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.769 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.3 mmp_? -73.07 -32.38 64.98 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.495 -0.414 . . . . 71.23 111.001 176.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.7 mm -58.82 -44.73 91.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.239 0.543 . . . . 71.14 109.933 173.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 t -58.65 -43.83 88.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.814 -0.63 . . . . 70.15 110.762 174.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.4 m -54.79 -50.43 68.54 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.034 0.445 . . . . 72.3 111.218 177.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 34.9 tp -60.38 -54.83 40.89 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.833 -0.622 . . . . 72.41 112.111 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.83 -41.03 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.011 0.374 . . . . 71.41 112.011 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.1 p -59.75 -42.42 93.18 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.627 0.251 . . . . 75.34 111.336 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 21.7 t80 -63.05 -44.01 97.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.613 0.244 . . . . 53.35 110.932 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -45.93 93.4 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.051 -0.595 . . . . 70.25 112.917 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.91 78.71 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.035 0.445 . . . . 61.25 111.689 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -62.02 -43.43 98.86 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.024 0.44 . . . . 71.42 110.894 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.484 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 91.2 t -65.11 -38.33 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.405 -0.361 . . . . 62.51 110.678 176.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.99 -43.12 66.21 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.794 0.33 . . . . 64.21 111.609 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.688 ' HE2' ' HG3' ' A' ' 20' ' ' GLN . 61.9 mttm -56.61 -49.22 75.57 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.209 0.528 . . . . 71.14 111.295 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.507 ' O ' HG12 ' A' ' 112' ' ' ILE . 77.1 t60 -62.66 -35.38 79.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.145 -0.48 . . . . 73.14 110.938 179.297 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 117' ' ' SER . 96.1 mt -62.73 -49.52 74.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.34 -0.391 . . . . 74.23 110.977 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.482 ' HA ' ' HG3' ' A' ' 115' ' ' GLU . 85.8 tttt -57.99 -41.53 83.2 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.312 -0.403 . . . . 72.01 111.569 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 96.4 m -59.86 -41.58 91.8 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.13 -0.486 . . . . 63.3 111.849 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.507 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.5 pt -94.53 23.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.099 0.407 . . . . 74.44 112.099 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 70.37 1.36 3.57 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.096 0.776 . . . . 71.2 113.096 174.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 68' ' ' ILE . 15.1 mm100 -86.22 35.62 0.65 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 112.549 0.574 . . . . 71.35 112.549 -175.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.482 ' HG3' ' HA ' ' A' ' 110' ' ' LYS . 37.6 mt-10 -56.65 -31.76 64.7 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.671 0.272 . . . . 62.0 111.71 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 m -55.06 -32.35 61.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.002 0.43 . . . . 73.44 111.319 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' SER . . . . . 0.499 ' HB2' HD13 ' A' ' 109' ' ' LEU . 50.1 m -70.17 -27.72 64.75 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.138 -0.483 . . . . 70.51 112.157 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.4 mt -54.51 -41.11 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.254 0.465 . . . . 64.54 112.254 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.554 ' HG2' ' NH2' ' A' ' 18' ' ' ARG . 30.8 mt-10 -65.57 -55.91 21.56 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 112.724 0.639 . . . . 73.32 112.724 -174.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.84 -28.15 51.1 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 121.78 1.653 . . . . 63.41 112.355 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.443 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.2 tt -64.29 -45.26 88.75 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 109.87 -0.419 . . . . 71.45 109.87 175.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.511 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -57.06 -37.61 72.06 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.969 0.414 . . . . 71.05 111.196 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.51 -36.52 73.81 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.179 -0.464 . . . . 73.22 111.718 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 80.0 p -62.58 -41.2 98.8 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 75.23 111.318 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.02 -52.91 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 63.4 110.975 177.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.9 m -69.55 -33.61 73.01 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.843 -0.617 . . . . 52.34 111.523 178.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.57 -52.91 63.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.684 0.278 . . . . 75.14 111.371 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.6 t -65.43 -41.16 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.11 0.481 . . . . 61.31 110.818 178.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.566 ' HG ' HD11 ' A' ' 137' ' ' LEU . 51.9 tp -54.81 -52.39 62.84 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.847 -0.615 . . . . 74.13 111.427 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.415 HG13 ' HD3' ' A' ' 134' ' ' ARG . 92.7 t -75.57 -26.94 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.142 -0.481 . . . . 75.21 111.708 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -60.53 -26.51 66.93 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.021 0.378 . . . . 73.13 112.021 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -131.44 -40.82 1.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.051 1.13 . . . . 71.41 114.051 -179.316 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.598 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.3 mptp? -103.25 20.64 17.34 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.692 0.997 . . . . 74.54 113.692 -174.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.541 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.9 ttp180 -56.05 -51.27 68.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.293 0.497 . . . . 74.31 111.607 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -57.39 -45.78 84.14 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.298 -0.41 . . . . 73.44 111.31 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -62.99 -38.33 90.74 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.411 -0.359 . . . . 64.33 111.586 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.566 HD11 ' HG ' ' A' ' 129' ' ' LEU . 65.1 mt -56.15 -49.74 73.09 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.916 0.339 . . . . 70.01 111.916 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.2 p -78.09 -42.25 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 112.166 0.432 . . . . 74.44 112.166 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -67.59 -62.47 1.4 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.169 0.433 . . . . 74.42 112.169 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.5 -8.69 59.31 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.809 0.338 . . . . 70.42 111.441 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 137' ' ' LEU . 46.2 mtt-85 60.62 83.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.551 0.691 . . . . 75.03 111.245 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -66.61 -52.92 31.03 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 115.291 -0.868 . . . . 64.22 114.125 -174.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.416 ' O ' HG23 ' A' ' 147' ' ' VAL . 50.2 m95 -68.0 -39.73 83.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.007 0.432 . . . . 73.14 111.437 -175.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -70.6 -52.8 19.03 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.788 0.327 . . . . 70.1 110.901 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -57.3 -38.87 88.88 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 116.182 -0.463 . . . . 63.34 113.446 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.57 -56.32 23.72 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.254 0.55 . . . . 73.0 111.59 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.557 HG11 ' HB2' ' A' ' 39' ' ' LYS . 90.1 t -59.93 -45.21 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.285 0.564 . . . . 72.34 112.053 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.68 -24.88 60.02 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.958 -0.565 . . . . 71.24 111.883 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -58.05 -49.1 78.04 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.051 0.453 . . . . 71.11 110.835 172.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -82.52 -3.79 56.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.995 0.368 . . . . 75.44 111.995 178.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 24.1 t60 60.41 81.47 0.18 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.16 0.505 . . . . 72.41 111.702 179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.471 0.608 0 CA-C-O 121.21 0.528 . . . . 71.43 110.545 178.807 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.785 0.326 . . . . 65.23 111.547 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -55.46 -37.27 67.54 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.394 0.616 . . . . 75.14 109.928 172.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.87 -41.47 74.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.545 -0.752 . . . . 65.25 111.554 174.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -67.41 -39.97 85.56 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.93 0.395 . . . . 71.45 110.565 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -67.18 -42.74 83.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.333 -0.394 . . . . 74.41 111.539 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.46 ' O ' HG13 ' A' ' 12' ' ' ILE . 7.5 tt0 -61.61 -52.25 65.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.836 0.351 . . . . 64.14 111.222 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 p -58.86 -52.4 65.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.156 -0.475 . . . . 61.1 111.253 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' HG2' ' A' ' 123' ' ' GLU . 46.1 tp -54.55 -44.4 72.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.17 -0.468 . . . . 73.33 111.54 176.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.02 -51.03 71.37 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.114 0.483 . . . . 72.42 111.402 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 8' ' ' GLN . 75.0 mt -59.59 -52.41 61.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.182 -0.463 . . . . 75.4 111.34 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 17' ' ' LEU . 71.5 mt -62.62 -43.52 98.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 116.133 -0.485 . . . . 72.11 111.751 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 29.3 t -56.04 -54.87 39.73 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.966 0.412 . . . . 70.52 111.929 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.432 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 85.5 mtt-85 -68.3 -34.35 75.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.543 -0.299 . . . . 61.41 111.326 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.401 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 48.7 t80 -59.71 -50.92 71.95 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.904 0.383 . . . . 73.24 111.332 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.8 mp -60.64 -37.94 83.14 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 122.288 -0.258 . . . . 75.53 111.488 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 14' ' ' SER . 49.8 mmm-85 -65.71 -56.71 10.64 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 111.875 0.324 . . . . 75.21 111.875 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 10.5 pt-20 -57.17 -39.13 74.71 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.989 0.424 . . . . 70.14 112.085 -178.183 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 35.5 mm-40 -68.03 -37.27 81.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.827 0.346 . . . . 75.33 111.303 177.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.23 -36.07 61.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.37 0.508 . . . . 54.0 112.37 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.416 HG22 ' HE3' ' A' ' 110' ' ' LYS . 71.9 p -85.8 -37.0 19.74 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.798 0.333 . . . . 65.21 111.669 -175.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.659 0 C-N-CA 121.098 -0.572 . . . . 74.34 112.487 -177.537 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.908 0 N-CA-C 114.659 0.623 . . . . 61.41 114.659 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.23 -49.73 73.32 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.535 0.569 . . . . 53.21 112.535 -175.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.437 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 89.1 m -57.25 -46.34 83.12 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.931 0.396 . . . . 71.11 111.422 -179.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.406 ' HA ' HD11 ' A' ' 12' ' ' ILE . 22.7 p -70.47 -30.98 67.94 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.532 -0.304 . . . . 74.1 111.779 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -70.76 -56.14 7.04 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.656 0.243 . . . . 61.1 111.656 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.579 ' HG3' HG21 ' A' ' 147' ' ' VAL . 51.2 pttt -60.08 -37.26 79.37 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.739 0.304 . . . . 74.41 111.181 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.65 -46.76 89.08 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.714 0.292 . . . . 44.42 111.152 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.82 -54.1 50.24 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.993 0.425 . . . . 73.24 112.039 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 11.9 pt-20 -71.34 -26.4 62.81 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.332 0.493 . . . . 64.34 112.332 -176.192 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 47' ' ' VAL . 96.3 m -72.35 -36.47 68.81 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.976 -0.452 . . . . 73.02 110.734 173.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.1 mt -54.25 -49.92 68.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.049 0.389 . . . . 73.45 112.049 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 42' ' ' GLU . 5.6 ptp180 -62.35 -42.36 99.33 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.424 0.527 . . . . 72.5 112.424 -176.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -72.69 -33.07 66.26 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.364 0.505 . . . . 73.31 112.364 -174.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -93.99 -29.64 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.911 0.386 . . . . 70.14 111.721 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -77.04 -50.57 6.75 Favored Glycine 0 CA--C 1.522 0.497 0 CA-C-N 116.229 -0.442 . . . . 72.45 113.936 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -53.02 -45.78 68.13 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 117.11 0.455 . . . . 61.04 111.406 -176.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.58 -47.44 90.03 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.105 -0.569 . . . . 75.12 112.839 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.9 t -57.77 -45.05 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.86 0.362 . . . . 64.11 110.905 176.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 76.6 mt-30 -56.32 -41.62 76.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.156 176.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -67.42 -47.7 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.382 0.512 . . . . 61.02 112.382 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -70.82 -32.83 70.02 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.283 0.563 . . . . 71.32 111.425 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -81.42 -18.37 45.64 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.247 -0.433 . . . . 74.25 112.077 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 35.1 tt0 -48.84 -43.56 38.71 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.578 0.585 . . . . 72.11 112.578 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.0 t -55.2 -34.67 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.928 0.394 . . . . 74.43 111.608 178.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.77 -41.37 21.27 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.368 -0.378 . . . . 63.21 111.799 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -64.7 -40.87 96.12 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.96 0.356 . . . . 63.15 111.96 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 11.3 mm100 -54.37 -36.31 63.75 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.8 0.333 . . . . 71.23 111.344 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.57 -31.7 63.87 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 116.188 -0.46 . . . . 74.53 112.834 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 59.1 mtm -89.27 -43.82 10.69 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.72 0.295 . . . . 54.12 111.019 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mp -53.07 -34.24 55.66 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.236 0.458 . . . . 73.44 112.236 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -66.09 -28.99 69.24 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.105 0.409 . . . . 73.33 112.105 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -9.24 23.15 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.121 0.486 . . . . 73.33 111.273 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -89.58 -74.87 0.46 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.31 -0.405 . . . . 75.31 111.155 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 t70 34.29 91.03 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.951 0.9 . . . . 72.35 112.249 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 68' ' ' ILE . 1.7 mp -64.3 104.21 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.87 -0.605 . . . . 64.43 111.888 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.73 -6.15 27.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.138 -0.483 . . . . 71.24 111.697 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.439 HD22 ' HB2' ' A' ' 72' ' ' ASP . 23.9 p-10 -161.13 164.72 30.43 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.766 0.317 . . . . 64.04 111.324 173.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.95 -30.66 64.25 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.381 0.512 . . . . 62.23 112.381 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' HD22 ' A' ' 70' ' ' ASN . 1.2 m-20 -54.65 -36.7 64.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.095 0.405 . . . . 74.41 112.095 177.033 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 54.7 m-20 -62.69 -43.15 99.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.03 0.443 . . . . 71.4 110.409 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.3 t -58.25 -48.22 85.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 116.029 -0.532 . . . . 54.33 111.014 177.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -59.83 -33.22 71.48 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.068 0.461 . . . . 74.34 111.095 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.1 t -70.12 -34.25 72.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.387 -0.37 . . . . 61.15 111.375 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.423 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.8 mt -58.35 -32.74 68.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.679 0.276 . . . . 72.22 111.111 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.2 t -52.76 -35.48 56.45 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.014 0.435 . . . . 65.12 111.167 176.021 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -63.63 -46.46 85.61 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.992 0.425 . . . . 74.44 110.57 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 84' ' ' VAL . 60.1 t -58.22 -43.07 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.396 -0.366 . . . . 75.21 110.629 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.3 mmt -56.58 -38.79 72.48 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.855 -0.611 . . . . 72.52 111.84 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 78' ' ' SER . 55.2 mt -65.1 -36.49 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.169 0.509 . . . . 51.11 110.95 175.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -74.85 -27.76 60.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.246 -0.434 . . . . 72.34 112.103 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 80' ' ' VAL . 70.8 t -52.2 -34.85 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 CA-C-O 120.859 0.362 . . . . 71.53 111.304 177.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.481 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.6 m-85 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 112.408 0.521 . . . . 74.34 112.408 178.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.0 m95 . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 112.608 0.596 . . . . 71.11 112.608 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.55 52.98 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 121.185 -0.531 . . . . 70.14 113.309 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -70.24 -30.63 67.74 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.97 0.414 . . . . 54.31 111.264 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.36 -39.23 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 121.275 0.56 . . . . 61.35 109.622 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.02 -47.7 89.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.593 -0.731 . . . . 72.04 110.775 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.1 m -53.4 -45.81 69.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 111.873 0.323 . . . . 74.22 111.873 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.481 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 40.3 tp -61.23 -55.1 35.91 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.162 0.505 . . . . 71.03 111.909 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.0 mt -68.73 -38.82 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.262 -0.426 . . . . 52.41 111.75 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.9 p -65.1 -45.41 85.32 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.285 -0.416 . . . . 72.34 111.048 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 25.1 t80 -56.74 -40.57 75.99 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.762 0.315 . . . . 62.34 110.781 174.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -48.34 84.71 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.037 -0.601 . . . . 62.33 112.457 174.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.74 -32.35 73.85 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.886 0.374 . . . . 71.2 111.584 177.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -64.73 -46.85 80.51 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.974 0.416 . . . . 74.42 110.688 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.465 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 61.1 t -65.74 -36.77 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 116.347 -0.388 . . . . 63.33 110.227 175.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.91 -46.94 78.28 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.126 -0.488 . . . . 61.44 111.847 177.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -54.78 -47.6 73.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.416 0.627 . . . . 64.12 110.601 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.488 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.9 t60 -63.17 -36.71 84.52 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.714 -0.675 . . . . 74.12 111.31 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 73.9 mt -63.61 -51.07 66.87 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 111.634 0.235 . . . . 74.12 111.634 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HE3' HG22 ' A' ' 22' ' ' THR . 65.9 tttm -61.25 -38.61 87.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.151 0.501 . . . . 64.44 110.507 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 93.7 m -57.84 -45.94 85.5 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.853 -0.612 . . . . 65.44 111.397 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.4 pt -88.22 22.09 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 120.752 0.31 . . . . 74.34 111.789 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 69.34 14.14 8.49 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.885 0.698 . . . . 64.43 112.885 173.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -100.78 37.24 1.76 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.167 0.432 . . . . 75.44 112.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.517 ' HG3' HD12 ' A' ' 118' ' ' ILE . 43.3 tt0 -60.2 -34.27 73.4 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.928 -0.482 . . . . 74.54 111.86 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.2 m -57.02 -28.93 62.92 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 122.177 -0.327 . . . . 65.32 111.843 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.7 m -73.48 -26.81 61.07 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.078 0.399 . . . . 63.44 112.078 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.517 HD12 ' HG3' ' A' ' 115' ' ' GLU . 66.2 mt -55.2 -45.92 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.772 0.656 . . . . 44.25 112.772 -177.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.81 -52.38 42.3 Favored Pre-proline 0 CA--C 1.549 0.925 0 N-CA-C 112.693 0.627 . . . . 54.52 112.693 -174.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -59.04 -27.87 86.24 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.568 1.512 . . . . 72.43 112.354 173.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.416 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.8 tt -64.73 -44.95 88.49 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.837 -0.431 . . . . 72.25 109.837 173.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.512 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.26 -40.54 82.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.057 0.456 . . . . 70.1 111.099 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 10' ' ' LEU . 32.3 mt-10 -63.09 -36.63 84.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.088 -0.506 . . . . 74.22 111.119 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.2 m -65.27 -44.24 88.69 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.595 -0.275 . . . . 71.53 111.287 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' LEU . 48.7 mm -53.98 -53.13 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.131 0.491 . . . . 63.13 110.61 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -62.93 -39.84 95.81 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.669 -0.696 . . . . 74.21 111.625 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -54.35 -51.61 64.22 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.419 -0.355 . . . . 64.14 111.173 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 132' ' ' THR . 58.8 t -68.36 -46.27 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.296 -0.411 . . . . 60.11 111.13 177.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -51.56 -52.8 44.27 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.848 -0.615 . . . . 72.34 111.89 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 66.0 t -76.06 -32.19 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 116.194 -0.457 . . . . 45.33 111.861 -178.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -56.19 -39.38 72.34 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.042 0.386 . . . . 73.31 112.042 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.448 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.5 t -104.57 -42.64 5.37 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.886 0.699 . . . . 63.3 112.886 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.404 ' HD3' HG23 ' A' ' 132' ' ' THR . 12.4 mptt -102.47 26.12 8.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.681 0.623 . . . . 54.41 112.681 -176.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 1.1 tpm_? -45.28 -53.08 8.86 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.088 0.555 . . . . 74.31 112.256 175.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 3.9 m-20 -69.6 -52.19 28.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 73.34 111.779 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -58.85 -37.94 77.61 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.06 0.392 . . . . 73.44 112.06 -176.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 34.1 mt -54.79 -51.51 65.55 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.037 0.384 . . . . 75.4 112.037 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' VAL . . . . . 0.446 ' HB ' HH21 ' A' ' 134' ' ' ARG . 14.8 p -79.0 -36.56 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 112.441 0.534 . . . . 72.52 112.441 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 73.9 mmtt -65.52 -45.71 82.44 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.286 0.476 . . . . 64.43 112.286 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -102.32 7.05 40.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.619 0.247 . . . . 74.53 111.561 -176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 52.81 71.79 0.46 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.27 -0.423 . . . . 64.44 110.802 -176.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -49.62 -44.91 38.42 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 114.638 0.615 . . . . 74.12 114.638 -172.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -75.29 -20.02 59.35 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.447 0.536 . . . . 63.41 112.447 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -84.28 -51.06 7.29 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.897 0.379 . . . . 75.45 110.327 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -54.3 -40.31 67.69 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.961 -0.563 . . . . 23.14 113.153 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.35 -53.46 57.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 122.704 0.402 . . . . 60.44 111.894 175.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.579 HG21 ' HG3' ' A' ' 39' ' ' LYS . 80.0 t -64.22 -42.73 96.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.002 0.43 . . . . 53.25 111.988 -177.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.91 -27.81 61.23 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.911 0.337 . . . . 60.44 111.911 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -56.15 -46.35 79.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.194 0.521 . . . . 73.23 111.464 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -82.48 4.0 26.07 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.132 -0.485 . . . . 62.45 111.553 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 56.52 54.44 7.47 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.806 0.669 . . . . 74.21 112.806 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 56.0 t . . . . . 0 CA--C 1.538 0.51 0 CA-C-O 121.255 0.55 . . . . 71.35 109.873 169.269 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 120.485 0.183 . . . . 72.15 111.446 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.18 -47.83 80.24 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.254 0.549 . . . . 71.52 111.472 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -68.05 -36.54 80.05 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.804 -0.635 . . . . 64.3 110.704 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.39 -51.55 65.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.842 -0.617 . . . . 71.53 110.523 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 7' ' ' ARG . 7.4 tpt180 -65.47 -40.78 93.58 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.726 0.269 . . . . 64.31 111.726 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -57.62 -52.94 63.37 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.996 0.427 . . . . 72.32 110.968 174.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.06 -40.57 94.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.001 -0.545 . . . . 71.22 110.755 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 123' ' ' GLU . 42.1 tp -59.48 -44.83 92.96 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.958 -0.565 . . . . 43.51 111.518 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 42.7 tt0 -64.91 -50.34 66.89 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.748 0.309 . . . . 71.22 110.982 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.5 -48.03 80.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.884 0.373 . . . . 74.02 111.374 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.469 ' O ' HD13 ' A' ' 17' ' ' LEU . 81.0 mt -64.8 -44.67 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 116.492 -0.322 . . . . 64.4 111.43 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 38.5 t -53.96 -50.96 65.33 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.954 0.407 . . . . 74.15 111.109 177.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 61.7 mtt-85 -61.26 -49.19 78.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.225 -0.443 . . . . 74.34 111.105 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.404 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 20.1 t80 -53.95 -50.85 65.57 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.069 0.396 . . . . 64.23 112.069 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -55.77 -46.82 77.83 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.947 0.404 . . . . 74.22 111.352 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 14' ' ' SER . 35.2 mtp180 -66.02 -53.57 36.86 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 73.33 112.07 -179.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.531 ' CD ' HH21 ' A' ' 45' ' ' ARG . 15.1 pt-20 -62.59 -31.04 71.79 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 111.883 0.327 . . . . 72.34 111.883 -179.386 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.57 -27.92 58.77 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.936 0.398 . . . . 71.03 111.241 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.69 -40.7 17.06 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.945 0.402 . . . . 74.34 111.708 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.408 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 44.2 p -87.39 -37.19 17.28 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.003 0.43 . . . . 73.31 111.955 -177.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 C-N-CA 121.263 -0.494 . . . . 32.41 112.767 -176.171 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.898 0 N-CA-C 112.443 -0.263 . . . . 73.5 112.443 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -50.63 69.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.136 0.421 . . . . 71.45 112.136 -176.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.06 -33.62 72.31 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.008 0.432 . . . . 73.52 111.176 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.9 t -68.89 -40.99 78.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.38 -0.373 . . . . 64.13 111.15 178.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -62.61 -50.32 71.72 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.42 0.629 . . . . 63.0 110.539 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -57.78 -45.4 86.04 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.165 -0.925 . . . . 71.41 111.829 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.439 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -59.4 -49.94 75.89 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.932 0.396 . . . . 62.43 111.383 177.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.9 tp -60.52 -52.6 64.52 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.268 -0.424 . . . . 71.2 111.862 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -61.02 -32.95 72.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.784 0.326 . . . . 50.11 111.589 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.499 ' O ' HG22 ' A' ' 47' ' ' VAL . 83.4 m -73.57 -41.4 62.97 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.269 -0.27 . . . . 60.34 110.836 177.113 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.8 mt -54.34 -45.64 72.73 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.142 0.423 . . . . 62.15 112.142 178.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.531 HH21 ' CD ' ' A' ' 19' ' ' GLU . 12.5 ptp180 -65.02 -42.26 94.56 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.169 -0.332 . . . . 74.11 111.705 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 46' ' ' ARG . 13.8 ttm180 -68.43 -45.29 72.98 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.921 0.341 . . . . 64.22 111.921 -176.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 21.0 m -86.32 -31.01 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.908 0.385 . . . . 70.5 111.709 -179.226 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.98 94.1 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.321 -0.466 . . . . 70.3 112.944 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.499 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 17.9 t70 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.881 0.372 . . . . 72.43 110.823 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.4 -46.42 80.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 121.307 -0.473 . . . . 52.52 112.966 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.66 -42.32 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 120.871 0.367 . . . . 63.21 111.168 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.539 HE22 ' HE2' ' A' ' 107' ' ' LYS . 27.9 mt-30 -63.25 -43.01 99.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.27 -0.423 . . . . 71.22 111.924 179.19 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 45.3 mtm-85 -58.2 -45.35 87.77 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.014 0.435 . . . . 70.01 111.611 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -73.87 -45.33 51.62 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.212 0.529 . . . . 72.35 111.656 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -77.27 -16.16 59.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.228 0.825 . . . . 63.44 113.228 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -46.87 -52.18 14.99 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.029 0.752 . . . . 74.23 113.029 -172.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 t -60.29 -30.62 69.58 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.022 0.379 . . . . 54.34 112.022 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.74 -50.94 11.37 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.983 0.421 . . . . 74.12 111.45 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -60.46 -42.26 95.8 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.167 0.432 . . . . 72.5 112.167 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -51.43 -39.88 58.25 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 111.955 0.354 . . . . 74.45 111.955 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.94 -34.74 72.96 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 121.289 -0.481 . . . . 64.02 113.253 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.485 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 49.1 mtm -89.77 -35.23 15.84 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.335 0.588 . . . . 63.21 110.314 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.555 HD21 ' HB2' ' A' ' 108' ' ' HIS . 14.7 tp -56.99 -42.41 80.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.616 -0.72 . . . . 64.02 111.793 -175.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.15 -15.47 63.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.961 0.726 . . . . 73.14 112.961 -177.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 0.74 19.32 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.24 0.543 . . . . 73.13 111.225 174.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 62' ' ' MET . 94.8 mt -96.23 -69.7 0.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.036 -0.529 . . . . 73.22 110.705 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 69.63 -52.08 0.62 Allowed 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 113.649 0.981 . . . . 62.34 113.649 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.436 HD11 HD21 ' A' ' 77' ' ' LEU . 2.4 mp 64.94 99.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.483 0.713 . . . . 65.31 111.478 -174.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.09 -14.89 13.82 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.306 -0.406 . . . . 72.44 112.019 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -150.56 173.45 14.09 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.625 0.25 . . . . 63.11 110.946 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.77 -35.48 68.71 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.557 0.577 . . . . 74.21 112.557 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -54.29 -42.26 69.86 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 122.311 -0.243 . . . . 62.52 111.472 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 44.3 m-20 -63.29 -43.54 97.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.094 0.473 . . . . 52.34 110.559 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.3 t -57.99 -46.7 87.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.932 -0.576 . . . . 75.4 111.189 176.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -69.61 -28.57 66.05 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.895 0.379 . . . . 70.15 111.481 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.7 m -68.33 -32.04 71.87 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.912 0.387 . . . . 64.34 110.778 174.618 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.475 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.6 mt -59.73 -34.26 72.71 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.732 0.301 . . . . 71.1 110.852 174.548 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.1 t -52.64 -35.73 55.33 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.27 -0.423 . . . . 63.13 111.576 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -58.25 -42.3 86.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.975 0.417 . . . . 74.43 110.969 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 65.9 t -73.46 -39.25 54.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.136 0.494 . . . . 73.41 110.845 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 98' ' ' LEU . 18.2 mmt -56.74 -39.92 74.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.04 -0.527 . . . . 74.23 111.532 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -60.0 -35.49 61.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.818 0.342 . . . . 43.11 111.389 175.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -65.33 -39.45 92.44 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.895 0.378 . . . . 65.52 111.328 176.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.7 t -58.59 -32.83 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 120.893 0.378 . . . . 71.31 111.404 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.488 ' CE2' HD22 ' A' ' 98' ' ' LEU . 17.0 m-30 . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 112.504 0.557 . . . . 63.04 112.504 178.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.45 ' HE3' HG13 ' A' ' 95' ' ' ILE . 33.1 m95 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 120.653 0.263 . . . . 73.45 111.457 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.97 -37.82 45.64 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.589 -0.338 . . . . 64.45 113.341 177.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 94' ' ' ARG . 22.2 mmt180 -66.31 -40.74 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 122.491 -0.417 . . . . 73.43 111.43 176.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.45 HG13 ' HE3' ' A' ' 92' ' ' TRP . 37.2 mm -61.53 -44.47 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.274 0.559 . . . . 73.51 110.062 175.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 92' ' ' TRP . 51.6 t -60.89 -41.15 87.72 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.831 -0.622 . . . . 70.24 110.963 175.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.1 m -55.44 -48.13 74.94 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.747 0.308 . . . . 53.44 111.277 178.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.557 HD11 ' SD ' ' A' ' 81' ' ' MET . 19.4 tp -62.56 -54.44 39.81 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.148 0.499 . . . . 71.12 111.501 -179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.9 mt -64.85 -38.31 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.048 -0.523 . . . . 74.04 111.497 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -63.21 -45.5 91.41 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.223 -0.444 . . . . 64.41 111.168 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 105' ' ' VAL . 26.5 t80 -61.05 -39.17 88.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.735 0.302 . . . . 74.34 110.568 175.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.13 -47.35 88.25 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 121.022 -0.609 . . . . 51.04 112.474 174.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.32 -35.57 81.4 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.203 0.525 . . . . 62.5 111.471 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.07 -46.73 87.8 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.023 -0.535 . . . . 70.22 110.848 177.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 101' ' ' PHE . 46.4 t -65.56 -36.43 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 116.353 -0.385 . . . . 73.11 110.613 175.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.06 -39.43 69.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.338 -0.392 . . . . 64.43 111.721 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.539 ' HE2' HE22 ' A' ' 52' ' ' GLN . 67.9 mttm -58.42 -44.47 89.09 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.226 0.536 . . . . 75.22 110.932 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.555 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.1 t60 -65.66 -42.62 91.16 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.128 -0.487 . . . . 74.53 110.701 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.431 HD21 ' HB ' ' A' ' 68' ' ' ILE . 97.5 mt -59.66 -50.36 74.18 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.287 -0.415 . . . . 63.14 111.086 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HE2' ' HA ' ' A' ' 22' ' ' THR . 64.7 tttp -56.26 -43.8 79.07 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.282 -0.417 . . . . 74.21 111.412 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.0 m -60.69 -44.04 97.02 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.166 -0.47 . . . . 64.13 112.011 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 108' ' ' HIS . 34.3 pt -89.68 16.46 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 N-CA-C 112.308 0.484 . . . . 65.12 112.308 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 75.98 7.29 3.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.007 0.743 . . . . 61.54 113.007 175.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -82.72 33.69 0.43 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.551 0.34 . . . . 71.11 111.645 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.4 ' CD ' HH21 ' A' ' 18' ' ' ARG . 2.4 tm-20 -57.03 -30.76 64.49 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.043 0.449 . . . . 71.21 111.433 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.431 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 58.7 m -69.62 -39.66 77.06 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.18 -0.325 . . . . 53.2 111.636 176.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.6 m -54.69 -26.31 32.78 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.074 0.398 . . . . 64.35 112.074 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.0 mt -53.89 -39.18 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 112.097 0.406 . . . . 70.45 112.097 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.23 -54.99 16.74 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 112.518 0.562 . . . . 70.04 112.518 -175.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.431 ' HD2' ' O ' ' A' ' 116' ' ' SER . 20.9 Cg_endo -61.35 -26.85 82.15 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.769 1.646 . . . . 61.45 112.394 174.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.68 -47.44 75.44 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.776 -0.453 . . . . 74.41 109.776 174.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.5 -36.81 69.59 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.052 -0.522 . . . . 71.5 111.143 174.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HA ' HD13 ' A' ' 10' ' ' LEU . 44.7 mt-10 -63.85 -44.94 91.64 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.353 -0.385 . . . . 73.44 111.159 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -60.77 -45.25 95.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.786 0.326 . . . . 64.23 111.456 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.3 mm -53.76 -52.22 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.213 0.53 . . . . 43.2 110.734 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -66.32 -33.39 75.62 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.928 -0.578 . . . . 64.44 111.818 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.27 -51.63 65.34 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.833 0.349 . . . . 73.14 110.684 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 81' ' ' MET . 60.4 t -64.19 -36.73 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.017 0.437 . . . . 73.23 111.222 176.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.9 tp -57.51 -52.89 63.57 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.158 -0.474 . . . . 73.31 111.5 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 59.8 t -76.55 -24.66 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 116.426 -0.352 . . . . 72.41 111.658 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -44.74 -52.57 8.23 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.147 0.579 . . . . 74.42 112.513 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.04 -25.26 2.53 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.177 0.806 . . . . 72.11 113.177 -174.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 129' ' ' LEU . 1.1 mpmm? -85.27 11.39 10.17 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.647 -0.658 . . . . 73.05 111.847 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.404 ' HD3' HH11 ' A' ' 134' ' ' ARG . 9.0 tpt180 -47.39 -60.65 2.37 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 112.645 0.609 . . . . 64.52 112.645 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.93 -37.81 88.88 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 64.02 111.752 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -62.58 -38.98 92.21 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.751 0.31 . . . . 71.11 111.484 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.57 HD11 ' HG ' ' A' ' 129' ' ' LEU . 72.2 mt -59.79 -49.58 77.17 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.803 0.335 . . . . 44.21 111.67 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.9 p -75.44 -40.13 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.037 0.384 . . . . 61.13 112.037 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 36.4 mmtm -68.29 -44.09 76.25 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.386 0.513 . . . . 64.31 112.386 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -88.66 5.69 41.91 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.861 0.362 . . . . 71.11 110.99 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 59.57 29.28 18.83 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.084 0.554 . . . . 75.42 112.164 177.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.43 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 18.24 -86.93 0.0 OUTLIER Glycine 0 C--N 1.339 0.743 0 N-CA-C 115.917 1.127 . . . . 63.32 115.917 175.146 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.557 ' O ' HG23 ' A' ' 147' ' ' VAL . 14.1 m95 -75.09 -34.46 61.75 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.823 0.675 . . . . 70.21 112.823 -171.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -63.84 -52.49 59.88 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.04 0.448 . . . . 62.15 110.305 174.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.51 -35.6 92.14 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-N 115.863 -0.608 . . . . 50.13 112.718 178.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.17 -48.72 73.36 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.041 0.536 . . . . 64.42 111.998 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.4 t -65.1 -45.23 94.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.317 0.488 . . . . 62.32 112.317 -176.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -73.92 -27.46 61.04 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 122.143 -0.348 . . . . 64.44 111.872 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -57.09 -50.29 73.23 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.012 0.434 . . . . 71.25 111.326 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.37 -8.93 59.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.171 -0.468 . . . . 71.44 111.22 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 7.6 t60 65.27 71.91 0.43 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.475 0.71 . . . . 63.42 112.147 176.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 67.1 t . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 116.109 -0.496 . . . . 64.14 110.757 175.696 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 112.179 0.437 . . . . 74.53 112.179 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -52.02 -45.51 64.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.406 -0.361 . . . . 74.24 111.414 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.39 -41.81 73.17 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.006 0.373 . . . . 70.05 112.006 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -66.96 -51.92 49.2 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.869 0.366 . . . . 74.15 110.694 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -59.56 -37.12 77.62 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.226 -0.443 . . . . 72.35 111.284 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -65.4 -52.1 55.75 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.992 -0.549 . . . . 74.3 111.482 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.1 m -57.32 -48.48 78.86 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.283 -0.417 . . . . 73.12 110.912 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.11 -39.84 87.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.315 -0.402 . . . . 73.14 111.3 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.0 -52.1 66.91 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 72.44 111.526 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 60.1 mt -63.65 -53.14 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 115.964 -0.562 . . . . 72.41 111.51 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.1 mt -63.0 -49.33 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.979 -0.555 . . . . 74.13 112.144 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 t -54.6 -50.82 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.85 0.357 . . . . 62.14 111.091 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 52.2 mtt180 -55.09 -54.71 39.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.381 -0.372 . . . . 74.1 110.602 175.091 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -52.88 -44.93 67.25 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.547 0.573 . . . . 71.43 112.547 -175.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.3 mp -58.67 -51.43 69.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.643 0.259 . . . . 74.52 111.529 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -69.47 -26.31 64.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 120.75 -0.38 . . . . 72.3 111.894 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 6.3 mm-40 -64.34 -41.84 96.56 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.099 0.476 . . . . 74.33 110.652 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 25.7 mm-40 -72.26 -37.78 69.0 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.982 -0.554 . . . . 65.25 111.995 178.529 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.7 -43.65 88.51 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.92 0.391 . . . . 54.44 111.836 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.4 p -87.81 -37.81 16.25 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.847 0.356 . . . . 74.43 111.845 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 121.473 -0.394 . . . . 31.14 113.133 179.87 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 38' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.746 0 N-CA-C 112.175 -0.37 . . . . 55.54 112.175 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.5 -50.01 66.89 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.215 0.45 . . . . 72.01 112.215 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.458 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 86.8 m -57.08 -42.25 80.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.066 0.46 . . . . 55.52 111.394 -178.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 t -64.26 -43.87 93.51 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.354 -0.385 . . . . 74.02 111.77 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 34' ' ' GLY . 44.3 mtp-105 -65.24 -53.45 44.29 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.771 0.286 . . . . 73.23 111.771 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HG3' HG21 ' A' ' 147' ' ' VAL . 19.6 ptmt -56.11 -37.51 69.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.103 0.478 . . . . 74.02 111.049 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.53 -47.3 70.3 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.415 -0.357 . . . . 73.51 111.213 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.2 tp -62.76 -38.54 90.97 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.23 0.456 . . . . 70.33 112.23 -177.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.11 -34.37 61.69 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.671 0.272 . . . . 54.21 111.508 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.533 HG23 HG21 ' A' ' 152' ' ' VAL . 88.3 m -75.9 -40.22 54.82 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 111.923 0.342 . . . . 53.11 111.923 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.4 mt -53.53 -35.28 60.54 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.61 0.596 . . . . 54.23 112.61 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.444 HH21 ' HG ' ' A' ' 41' ' ' LEU . 12.7 ptp180 -77.86 -42.01 34.93 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.04 -0.412 . . . . 54.31 112.097 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.407 ' NH1' HG13 ' A' ' 152' ' ' VAL . 17.0 ptm180 -68.71 -32.53 72.39 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.05 0.389 . . . . 70.22 112.05 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 22.3 m -94.14 -34.77 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 O-C-N 121.978 -0.451 . . . . 74.41 111.777 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.34 -48.8 49.73 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.439 -0.41 . . . . 72.42 113.605 -174.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 34.6 t70 -63.31 -36.11 82.59 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 122.438 -0.448 . . . . 70.03 110.778 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -49.96 70.71 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 121.147 -0.549 . . . . 64.44 112.488 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 47' ' ' VAL . 81.7 t -57.91 -43.26 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.963 0.411 . . . . 61.44 111.161 175.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.406 ' O ' ' N ' ' A' ' 56' ' ' GLU . 43.0 mt-30 -54.51 -45.8 73.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.118 -0.492 . . . . 74.32 112.074 176.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 24.3 mmm180 -65.29 -50.01 67.35 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.077 0.769 . . . . 61.45 113.077 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -69.72 -30.57 68.22 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.741 -0.599 . . . . 61.41 110.911 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -82.13 -18.51 42.64 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.287 -0.415 . . . . 72.53 112.008 174.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 52' ' ' GLN . 37.1 tt0 -49.84 -48.15 51.21 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.325 0.491 . . . . 74.05 112.325 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -52.44 -33.73 45.45 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.949 0.404 . . . . 63.24 111.735 176.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.55 -54.29 5.8 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.295 -0.411 . . . . 62.14 111.585 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -56.59 -35.9 68.77 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.353 0.501 . . . . 75.44 112.353 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -56.44 -39.69 73.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.953 0.406 . . . . 44.11 110.91 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.445 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -61.52 -23.24 62.47 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 121.235 -0.507 . . . . 73.23 112.463 176.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 79.6 mtp -86.72 -55.4 3.88 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.706 0.288 . . . . 72.01 111.177 176.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.93 -33.15 66.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.783 0.66 . . . . 52.53 112.783 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.445 ' HE ' ' HA2' ' A' ' 61' ' ' GLY . 53.2 ptt85 -64.12 -30.84 71.88 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.941 -0.304 . . . . 74.32 111.543 178.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.04 -4.04 28.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 122.152 -0.343 . . . . 72.03 111.748 177.281 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.95 -71.86 0.66 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.068 0.461 . . . . 71.43 110.532 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 44.27 87.73 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.095 0.958 . . . . 72.13 112.517 -177.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.561 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.8 mp -70.19 115.41 9.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 115.881 -0.6 . . . . 74.35 111.701 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.56 -14.97 13.14 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.394 0.516 . . . . 75.41 112.394 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -148.52 172.6 14.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.227 -0.296 . . . . 70.12 111.075 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.6 -29.62 70.74 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.354 0.501 . . . . 64.11 112.354 -175.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.59 -39.57 88.59 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.769 0.319 . . . . 71.31 110.868 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.561 ' HB2' HG23 ' A' ' 68' ' ' ILE . 55.6 m-20 -59.65 -40.47 87.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.148 0.499 . . . . 73.24 110.562 175.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.4 t -58.53 -46.48 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 116.068 -0.515 . . . . 71.44 111.142 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.18 -32.43 73.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.91 0.386 . . . . 74.13 111.149 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -65.48 -37.71 87.61 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.932 0.396 . . . . 55.14 110.372 174.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -60.01 -37.85 80.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.353 -0.385 . . . . 72.44 110.964 174.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -53.48 -42.67 67.48 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.957 0.408 . . . . 65.14 110.851 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 mmm-85 -59.91 -46.67 88.61 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.189 -0.459 . . . . 64.33 110.474 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.2 t -58.97 -39.16 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.891 0.377 . . . . 42.42 111.168 177.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.555 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.8 mmt -58.67 -38.02 77.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.166 0.508 . . . . 71.23 110.857 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.72 -38.94 74.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.978 -0.555 . . . . 72.24 110.904 173.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -68.89 -29.74 68.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.162 -0.472 . . . . 64.11 111.493 178.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 82.3 t -63.84 -28.27 44.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 120.901 0.381 . . . . 72.45 111.165 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 52.4 m-85 . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 112.452 0.538 . . . . 64.14 112.452 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.9 m95 . . . . . 0 N--CA 1.478 0.929 0 N-CA-C 113.174 0.805 . . . . 70.02 113.174 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.78 -24.37 33.02 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.448 -0.406 . . . . 64.02 112.805 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 2.3 mmp_? -57.47 -44.09 84.56 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.697 0.284 . . . . 73.45 111.078 174.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.8 mm -65.61 -49.96 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.026 0.441 . . . . 74.14 110.994 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' A' ' 146' ' ' PHE . 61.6 t -54.29 -52.87 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.006 -0.543 . . . . 74.33 111.276 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -58.04 -42.65 85.86 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.166 -0.47 . . . . 75.11 111.662 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.523 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 29.5 tp -58.83 -54.98 40.99 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.276 0.56 . . . . 43.31 111.552 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.5 mt -69.97 -35.58 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.038 -0.528 . . . . 75.12 111.501 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.3 m -65.71 -44.73 85.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.583 -0.28 . . . . 70.43 111.185 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 105' ' ' VAL . 30.8 t80 -61.7 -43.43 98.87 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.676 0.274 . . . . 74.44 110.809 176.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -46.08 93.14 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 120.92 -0.657 . . . . 60.41 112.481 175.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -34.02 76.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.914 0.387 . . . . 65.11 111.519 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -65.41 -45.72 82.82 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.322 -0.399 . . . . 73.22 110.703 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 46.1 t -66.37 -36.62 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 110.085 -0.339 . . . . 54.51 110.085 175.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.74 -43.72 85.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.179 -0.464 . . . . 64.43 111.534 175.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 97.5 mttt -55.42 -46.9 76.63 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.328 0.585 . . . . 73.21 110.716 174.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.412 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.9 t60 -64.7 -34.6 78.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.13 -0.487 . . . . 71.55 111.345 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.527 HD21 ' HB ' ' A' ' 68' ' ' ILE . 80.0 mt -64.45 -49.89 69.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.496 0.189 . . . . 75.43 111.446 178.642 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 110' ' ' LYS . 8.3 tmtm? -57.85 -39.44 77.73 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.209 0.528 . . . . 73.22 109.802 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 m -60.52 -33.58 72.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.07 -0.514 . . . . 65.53 111.817 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.5 pt -106.28 24.97 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 112.573 0.582 . . . . 64.24 112.573 -177.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 63.52 36.77 10.94 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.735 0.642 . . . . 62.4 112.735 175.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -117.32 33.01 5.83 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.746 0.308 . . . . 73.44 111.705 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.16 -30.97 40.2 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.104 0.409 . . . . 60.22 112.104 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.403 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 50.9 m -67.48 -37.12 82.39 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.775 0.321 . . . . 65.04 111.054 177.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.9 m -65.79 -27.2 68.1 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.093 0.405 . . . . 72.14 112.093 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.38 -39.28 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 112.476 0.547 . . . . 73.11 112.476 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -66.15 -55.54 20.49 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.604 0.594 . . . . 73.33 112.604 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.2 Cg_endo -59.78 -26.33 81.91 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 121.736 1.624 . . . . 72.5 112.113 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.3 tt -65.29 -48.22 73.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.811 -0.44 . . . . 63.52 109.811 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.14 -38.59 80.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.099 0.476 . . . . 73.21 111.226 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.39 -40.54 96.81 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 53.41 111.069 174.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.9 m -62.1 -46.66 88.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.799 0.333 . . . . 73.04 111.163 177.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 121' ' ' LEU . 45.8 mm -54.75 -51.9 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.283 0.563 . . . . 73.21 110.97 176.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.2 m -66.62 -39.2 88.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.812 -0.631 . . . . 60.24 111.89 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.603 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 30.5 t70 -59.54 -53.58 56.49 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.78 -0.191 . . . . 75.15 110.798 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.435 ' O ' HG22 ' A' ' 132' ' ' THR . 62.3 t -61.55 -43.43 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 120.908 0.385 . . . . 65.23 111.044 178.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.636 ' HG ' HD11 ' A' ' 137' ' ' LEU . 35.6 tp -49.6 -52.48 30.05 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.922 -0.581 . . . . 72.22 111.53 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.16 -34.51 26.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.332 0.586 . . . . 34.24 111.387 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 50.7 ttt180 -58.4 -33.36 69.56 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.831 0.852 . . . . 72.54 112.872 -174.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.642 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -116.66 -14.36 10.83 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.852 1.056 . . . . 51.34 113.852 -177.683 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.786 ' HZ2' ' HB3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.33 48.9 0.9 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.537 0.94 . . . . 71.25 113.537 174.938 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -51.69 -60.53 3.06 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.319 0.489 . . . . 74.11 112.319 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.82 -47.23 85.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.356 -0.384 . . . . 64.42 111.961 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 133' ' ' LYS . 95.3 m95 -53.32 -38.87 63.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.873 0.323 . . . . 74.33 111.873 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.636 HD11 ' HG ' ' A' ' 129' ' ' LEU . 46.0 mt -54.05 -51.13 65.03 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.228 -0.442 . . . . 74.35 112.167 177.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.68 -43.61 25.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 O-C-N 121.94 -0.475 . . . . 63.12 112.244 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -54.21 -52.63 60.65 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.174 0.512 . . . . 70.02 111.631 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -93.77 5.12 52.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.488 . . . . 72.44 111.43 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 59.31 38.76 23.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.38 -0.373 . . . . 73.31 111.945 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -27.04 -49.33 0.06 OUTLIER Glycine 0 N--CA 1.471 1.022 0 N-CA-C 116.238 1.255 . . . . 54.35 116.238 -173.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.423 ' O ' HG23 ' A' ' 147' ' ' VAL . 13.0 m95 -67.45 -51.39 52.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 117.733 0.766 . . . . 71.23 111.716 -178.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.82 -29.07 68.9 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.905 0.383 . . . . 73.44 111.11 174.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.546 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -69.43 -37.88 79.58 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.944 -0.463 . . . . 72.41 111.944 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' PHE . . . . . 0.408 ' CE1' HG22 ' A' ' 96' ' ' VAL . 19.1 t80 -60.45 -41.4 94.0 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.175 0.512 . . . . 71.33 110.88 173.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.513 HG21 ' HG3' ' A' ' 39' ' ' LYS . 58.4 t -70.73 -38.21 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 116.033 -0.53 . . . . 74.42 112.314 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.546 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.4 pt-20 -74.0 -40.07 63.2 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 122.274 -0.266 . . . . 71.54 111.629 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -58.24 -48.34 80.71 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.978 0.418 . . . . 62.41 111.463 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -80.75 -9.13 59.83 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.439 -0.346 . . . . 73.01 111.148 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 67.5 t60 57.93 63.02 1.89 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.458 0.647 . . . . 72.43 112.19 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.533 HG21 HG23 ' A' ' 43' ' ' THR . 87.4 t . . . . . 0 N--CA 1.467 0.416 0 CA-C-N 115.979 -0.555 . . . . 63.52 110.21 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 120.675 0.274 . . . . 75.03 111.547 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.6 -41.0 98.36 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.074 0.398 . . . . 74.12 112.074 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 ' HB3' ' A' ' 137' ' ' LEU . 63.4 tp -60.26 -41.58 93.54 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.702 0.287 . . . . 74.34 110.615 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -57.06 -49.04 77.08 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.272 -0.422 . . . . 74.41 110.82 174.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -63.73 -43.49 96.34 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.884 0.373 . . . . 73.34 111.714 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.443 ' O ' HG13 ' A' ' 12' ' ' ILE . 54.3 tt0 -62.66 -52.24 64.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.159 0.504 . . . . 71.2 111.308 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.1 p -61.61 -44.39 97.08 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.007 -0.542 . . . . 75.34 111.09 177.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.3 tp -53.61 -45.04 69.92 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.232 -0.44 . . . . 54.25 111.44 175.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.21 -51.43 69.02 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.715 0.293 . . . . 64.53 111.571 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 8' ' ' GLN . 62.9 mt -55.8 -51.89 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.117 0.484 . . . . 75.45 111.386 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.405 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.8 mt -66.72 -49.76 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.996 -0.547 . . . . 71.11 112.195 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 87.9 p -55.5 -47.84 75.56 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.88 0.371 . . . . 75.41 111.601 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -62.55 -41.94 99.22 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.406 -0.361 . . . . 73.05 111.615 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.415 ' OH ' ' HA3' ' A' ' 48' ' ' GLY . 56.0 t80 -61.07 -46.49 90.47 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.904 0.383 . . . . 74.32 111.043 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.1 mp -63.52 -34.56 78.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.47 -0.332 . . . . 64.52 111.601 177.388 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -62.95 -54.06 44.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.62 0.248 . . . . 65.44 111.477 176.552 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.0 -35.33 79.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.097 0.475 . . . . 74.01 111.624 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' A' ' 107' ' ' LYS . 71.6 mm-40 -72.37 -28.07 62.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.839 0.352 . . . . 73.04 111.724 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.6 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -72.89 -39.16 66.61 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 121.224 0.535 . . . . 74.2 110.928 175.553 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.5 p -87.62 -20.12 26.81 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.92 -0.582 . . . . 62.44 111.849 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.805 0 C-N-CA 121.654 -0.308 . . . . 31.01 113.779 175.692 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.746 0 CA-C-O 120.703 0.057 . . . . 60.35 113.167 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.1 70.21 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.996 0.739 . . . . 65.42 112.996 -173.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.1 m -54.7 -54.18 45.24 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 120.955 0.407 . . . . 73.54 111.856 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.2 m -71.85 -31.48 66.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.461 -0.336 . . . . 72.43 111.867 -177.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.3 tpt85 -64.02 -48.02 77.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 120.655 0.264 . . . . 65.31 111.438 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.425 ' HG3' HG21 ' A' ' 147' ' ' VAL . 6.1 ptmm? -76.2 -27.78 57.01 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.71 0.291 . . . . 65.2 111.41 178.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.57 -52.97 48.34 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.837 0.351 . . . . 61.22 110.948 174.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.5 tp -61.39 -38.27 86.43 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.176 0.512 . . . . 74.34 110.816 176.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.27 -40.52 90.67 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.92 -0.582 . . . . 64.03 110.827 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.621 HG23 HG21 ' A' ' 152' ' ' VAL . 93.6 m -69.64 -45.54 68.24 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.106 -0.497 . . . . 74.14 111.202 176.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.2 mt -54.28 -46.34 72.68 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.504 0.557 . . . . 72.21 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 45' ' ' ARG . 6.5 ptp180 -65.58 -34.11 77.48 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.152 -0.342 . . . . 73.12 111.447 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -73.07 -44.84 60.02 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 111.941 0.349 . . . . 74.41 111.941 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 51' ' ' VAL . 33.5 m -79.72 -34.12 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.793 0.33 . . . . 74.13 111.329 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' OH ' ' A' ' 16' ' ' TYR . . . -66.12 -39.35 94.59 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 121.459 -0.401 . . . . 53.3 112.859 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.99 -45.63 61.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.974 0.416 . . . . 72.35 111.417 174.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.44 -51.16 10.09 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 120.985 -0.626 . . . . 61.12 112.987 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.5 t -57.44 -53.48 43.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.372 0.508 . . . . 50.11 112.372 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -59.88 -44.81 93.99 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.204 0.446 . . . . 64.35 112.204 -177.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -65.44 -33.72 76.61 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.098 0.777 . . . . 74.11 113.098 -175.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -84.6 -34.14 23.21 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.336 -0.853 . . . . 74.42 111.062 176.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.6 m80 -75.47 -18.18 59.93 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.213 0.449 . . . . 72.31 112.213 177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.86 -55.19 10.37 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.644 0.609 . . . . 73.44 112.644 -174.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.8 t -58.93 -35.25 72.79 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.141 0.422 . . . . 62.22 112.141 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.72 -53.27 23.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.828 0.346 . . . . 74.11 111.649 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -63.92 -33.01 74.74 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.532 -0.303 . . . . 72.32 111.736 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 41.4 mm-40 -47.76 -46.79 30.56 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.554 0.216 . . . . 63.41 111.297 176.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.3 -41.07 61.64 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 121.233 -0.508 . . . . 74.11 112.913 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.466 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.9 mtp -70.51 -40.88 73.25 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.037 0.446 . . . . 75.31 111.081 178.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -62.2 -26.89 68.61 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.494 -0.321 . . . . 74.44 111.799 176.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 33.4 mtm180 -60.77 -26.57 67.33 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.233 0.457 . . . . 73.02 112.233 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 62' ' ' MET . 56.3 pttt -94.71 -8.98 36.19 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.863 0.363 . . . . 52.23 111.209 176.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.481 HD13 HD21 ' A' ' 77' ' ' LEU . 93.8 mt -105.92 -84.78 0.5 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.581 0.585 . . . . 71.22 112.581 -173.284 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.75 -22.41 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.529 0.937 . . . . 72.13 113.529 -173.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.466 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.4 mp 59.34 95.65 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.659 0.783 . . . . 75.32 112.456 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.79 -8.65 18.62 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.604 . . . . 74.34 111.443 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -161.35 -179.71 7.61 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.377 -0.374 . . . . 71.22 110.674 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 34.8 tt0 -59.74 -37.26 78.47 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.837 0.31 . . . . 65.44 111.837 -178.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -54.28 -36.13 63.32 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 111.863 0.32 . . . . 72.24 111.863 -174.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -61.75 -44.39 97.0 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.317 0.58 . . . . 73.54 110.618 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.03 -36.97 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 121.265 0.555 . . . . 60.02 110.828 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.6 mmmt -65.13 -31.34 72.49 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.025 0.44 . . . . 71.32 110.577 176.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -67.78 -40.39 83.97 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.059 0.456 . . . . 74.53 110.609 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.573 ' O ' ' HG2' ' A' ' 81' ' ' MET . 96.7 mt -55.91 -40.3 72.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.133 -0.485 . . . . 71.22 110.93 175.628 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.8 t -54.86 -44.5 74.06 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.018 0.437 . . . . 34.33 111.069 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -57.92 -44.23 86.75 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.147 -0.479 . . . . 74.42 110.803 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 84' ' ' VAL . 57.6 t -61.08 -41.81 90.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.207 -0.452 . . . . 64.0 111.131 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.4 mmt -57.7 -43.89 85.47 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.07 0.462 . . . . 62.12 111.241 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 68.6 mt -56.13 -41.27 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.232 0.539 . . . . 73.23 110.87 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.3 m80 -74.76 -26.35 59.71 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.447 0.536 . . . . 72.21 112.447 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 80' ' ' VAL . 78.8 t -55.91 -33.09 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.135 0.493 . . . . 74.54 111.178 174.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.493 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.3 m-85 . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 112.485 0.55 . . . . 60.03 112.485 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.404 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.1 m95 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.625 0.25 . . . . 71.42 111.413 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.46 -35.79 51.96 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 121.428 -0.415 . . . . 63.1 113.225 177.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -54.82 -40.41 69.53 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 111.998 0.37 . . . . 72.24 111.998 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.401 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.8 mm -66.64 -46.47 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 120.905 0.383 . . . . 52.3 110.839 177.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.7 t -57.93 -43.33 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 120.978 0.418 . . . . 74.14 110.838 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.1 m -59.82 -42.25 93.09 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.168 -0.469 . . . . 63.21 111.239 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.528 HD12 ' SD ' ' A' ' 81' ' ' MET . 29.1 tp -59.54 -54.67 43.82 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.258 0.552 . . . . 53.32 111.67 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.4 mt -69.7 -39.99 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 115.991 -0.549 . . . . 73.41 111.873 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.2 p -63.45 -45.76 89.38 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.593 -0.276 . . . . 72.33 111.743 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.66 -43.27 93.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.795 0.331 . . . . 72.14 111.018 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.43 -45.47 92.93 Favored Glycine 0 CA--C 1.529 0.906 0 C-N-CA 120.904 -0.665 . . . . 61.4 112.314 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.34 -35.32 80.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.113 0.482 . . . . 73.23 111.647 177.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -64.75 -40.82 95.93 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.151 -0.477 . . . . 73.14 111.242 178.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 59.9 t -71.9 -38.44 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 120.838 0.352 . . . . 72.12 110.673 176.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.43 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.68 0.622 . . . . 73.13 112.68 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -61.27 -38.89 88.38 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.849 0.357 . . . . 71.51 111.494 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.437 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.4 t60 -65.59 -36.71 84.54 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.746 0.308 . . . . 74.35 110.703 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 81.4 mt -62.95 -50.44 70.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.489 -0.323 . . . . 42.22 111.859 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.836 0.35 . . . . 51.03 111.075 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.2 m -57.48 -37.82 73.53 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.403 -0.362 . . . . 53.42 111.737 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.6 pt -97.56 21.66 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 120.913 0.387 . . . . 70.24 111.646 177.499 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 68.75 6.81 5.75 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.637 0.977 . . . . 72.01 113.637 174.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -82.87 40.92 0.71 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.281 0.474 . . . . 63.12 112.281 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.0 -33.01 72.58 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.859 -0.526 . . . . 74.31 111.27 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 38.8 m -56.74 -28.09 60.51 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.519 -0.31 . . . . 73.31 111.435 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.9 m -79.24 -27.04 42.4 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.769 0.318 . . . . 74.43 111.834 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.5 mt -59.73 -41.39 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.482 0.549 . . . . 74.32 112.482 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -62.2 -56.42 31.26 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 112.402 0.519 . . . . 65.32 112.402 -178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.19 -30.23 90.82 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.846 1.697 . . . . 62.33 112.419 176.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -64.14 -50.18 69.22 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 109.66 -0.496 . . . . 61.42 109.66 174.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.75 -41.54 77.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.008 -0.542 . . . . 74.34 111.381 177.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -61.91 -46.19 90.46 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.448 -0.342 . . . . 71.31 111.009 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.9 m -56.4 -38.34 71.39 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.206 0.447 . . . . 44.05 112.206 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.4 mm -57.2 -53.88 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.204 0.526 . . . . 72.41 111.014 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 38.3 m -71.41 -33.76 69.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.935 -0.575 . . . . 71.54 111.453 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -59.82 -51.58 69.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.165 -0.471 . . . . 73.45 111.163 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.614 ' O ' HG22 ' A' ' 132' ' ' THR . 63.1 t -64.29 -48.89 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 120.87 0.367 . . . . 64.45 110.633 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.59 ' HG ' HD11 ' A' ' 137' ' ' LEU . 59.8 tp -49.21 -52.65 25.58 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.878 -0.601 . . . . 73.34 111.817 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.589 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -66.28 -52.24 49.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.231 -0.441 . . . . 55.01 111.519 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 131' ' ' ARG . 42.3 ttm105 -48.18 -46.08 34.42 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.89 0.7 . . . . 71.13 112.89 -176.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 128' ' ' VAL . 3.8 t -99.93 -28.76 12.93 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.082 1.141 . . . . 73.01 114.082 -173.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.57 ' HD2' HG23 ' A' ' 132' ' ' THR . 1.4 mptp? -131.82 31.05 4.27 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.529 0.937 . . . . 75.04 113.529 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.589 ' HD3' HG13 ' A' ' 130' ' ' VAL . 37.3 tpt85 -54.5 -45.96 73.37 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.018 0.437 . . . . 73.43 111.754 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.11 -50.85 72.47 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.049 -0.523 . . . . 62.35 111.703 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -57.79 -37.09 73.1 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 111.956 0.354 . . . . 74.21 111.956 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.59 HD11 ' HG ' ' A' ' 129' ' ' LEU . 77.6 mt -57.16 -48.56 78.4 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.11 0.411 . . . . 74.32 112.11 177.433 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.19 -36.83 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 122.156 -0.34 . . . . 61.31 111.753 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.45 -53.36 59.06 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.009 0.433 . . . . 75.1 111.865 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -93.89 7.01 46.59 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.118 0.414 . . . . 73.21 112.118 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 52.97 54.51 10.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.017 0.437 . . . . 72.53 110.509 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.404 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -30.94 -56.69 0.27 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 115.964 1.146 . . . . 71.21 115.964 -170.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.506 ' O ' HG23 ' A' ' 147' ' ' VAL . 18.6 m95 -69.87 -44.19 70.31 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 117.388 0.594 . . . . 74.51 112.548 -173.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.65 -51.2 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.927 0.394 . . . . 74.43 111.14 174.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.14 -38.37 85.52 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 116.059 -0.519 . . . . 61.14 112.803 178.222 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -57.83 -53.79 54.28 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.037 0.446 . . . . 64.23 111.527 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 143' ' ' TRP . 29.8 t -66.02 -42.5 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.135 0.42 . . . . 72.44 112.135 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.427 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.3 pt-20 -70.43 -34.15 72.15 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 122.168 -0.332 . . . . 63.2 111.544 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -62.2 -47.48 84.25 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.994 0.426 . . . . 73.34 110.816 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -79.78 -4.63 52.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.304 -0.407 . . . . 74.24 111.391 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.7 p80 43.02 39.75 1.94 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.109 0.963 . . . . 71.22 112.964 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.621 HG21 HG23 ' A' ' 43' ' ' THR . 56.1 t . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 116.581 -0.281 . . . . 75.54 111.39 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 CA--C 1.547 0.836 0 CA-C-O 120.311 0.101 . . . . 73.21 111.025 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.53 -46.18 77.1 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.016 0.436 . . . . 73.05 111.26 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.55 -34.11 70.67 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.109 -0.496 . . . . 63.14 110.773 177.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.406 ' HE2' ' HA ' ' A' ' 127' ' ' ASP . 11.1 t80 -67.23 -43.4 82.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.963 -0.562 . . . . 62.32 110.536 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 7' ' ' ARG . 7.7 mmt180 -67.85 -43.63 79.01 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.189 0.44 . . . . 74.32 112.189 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -58.0 -50.85 71.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.208 0.528 . . . . 64.35 110.693 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.3 p -64.04 -51.89 62.02 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.907 -0.588 . . . . 63.25 111.544 178.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 61.7 tp -51.98 -42.73 63.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 111.857 0.317 . . . . 74.43 111.857 177.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -57.78 -52.83 63.87 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.124 0.488 . . . . 74.33 111.044 177.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.51 -48.38 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.851 -0.613 . . . . 71.44 111.897 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 99' ' ' ILE . 75.3 mt -64.09 -52.52 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.359 -0.382 . . . . 65.34 111.968 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.7 p -52.78 -47.72 67.33 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.807 0.337 . . . . 73.01 111.637 -178.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 74.6 mtt180 -57.52 -51.26 70.17 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.648 -0.251 . . . . 63.13 110.8 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -53.22 -39.27 63.63 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.02 0.378 . . . . 72.43 112.02 -177.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.9 mp -62.93 -46.14 89.17 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.57 0.211 . . . . 73.11 111.57 176.154 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.67 -34.69 78.88 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.118 -0.364 . . . . 70.31 111.356 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.0 mm-40 -56.63 -51.76 67.47 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.306 0.574 . . . . 73.31 111.114 176.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.4 ' HB3' ' HE2' ' A' ' 107' ' ' LYS . 27.8 mm-40 -77.97 -23.42 48.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.962 -0.563 . . . . 70.35 112.495 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.01 -48.27 21.66 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.978 0.418 . . . . 64.21 111.59 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.445 HG22 ' HE3' ' A' ' 110' ' ' LYS . 32.8 p -92.07 -38.77 12.01 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.095 0.405 . . . . 60.0 112.095 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.842 0 C-N-CA 121.217 -0.516 . . . . 65.15 112.696 -175.076 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.604 0 CA-C-O 120.562 -0.021 . . . . 35.24 113.122 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.77 -50.11 71.33 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 111.837 0.31 . . . . 53.1 111.837 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -61.68 -53.25 58.59 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.015 0.376 . . . . 54.24 112.015 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.2 m -60.83 -33.06 72.46 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.842 0.353 . . . . 64.5 111.635 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 -68.03 -56.53 8.57 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.841 0.353 . . . . 73.44 111.408 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 16.9 ptmt -64.41 -32.05 73.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.403 -0.362 . . . . 72.03 111.518 -177.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -47.5 78.9 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.842 0.354 . . . . 70.43 111.089 175.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HG ' HH21 ' A' ' 45' ' ' ARG . 51.7 tp -64.67 -38.0 89.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.286 0.476 . . . . 73.02 112.286 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 12.1 pt-20 -75.79 -34.67 60.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.002 -0.436 . . . . 73.03 111.415 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.536 ' OG1' HG21 ' A' ' 152' ' ' VAL . 56.8 m -67.47 -38.67 84.75 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.083 -0.386 . . . . 53.51 111.138 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.64 -43.87 69.12 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.925 0.342 . . . . 74.41 111.925 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.504 HH21 ' HG ' ' A' ' 41' ' ' LEU . 16.0 ptp180 -78.72 -36.65 43.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.828 0.346 . . . . 74.22 111.176 177.22 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.483 ' NH1' HG13 ' A' ' 152' ' ' VAL . 32.4 ttt180 -57.12 -43.13 82.03 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.169 0.587 . . . . 74.42 112.163 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -101.59 -33.96 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.855 0.36 . . . . 63.52 111.642 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.454 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -61.96 -35.9 92.07 Favored Glycine 0 C--N 1.333 0.375 0 CA-C-N 116.317 -0.401 . . . . 75.11 113.614 -177.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 28.4 t70 -54.68 -55.49 29.13 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.064 0.459 . . . . 75.3 110.981 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.05 99.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.13 -0.557 . . . . 53.41 112.752 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 47' ' ' VAL . 65.6 t -57.28 -46.98 85.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 O-C-N 122.659 -0.318 . . . . 70.22 111.504 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.9 mt-30 -55.86 -46.66 78.18 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.655 0.264 . . . . 44.15 111.158 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 35.3 mtp85 -60.92 -41.12 95.55 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.179 0.437 . . . . 63.11 112.179 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -71.48 -37.57 71.29 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.242 0.544 . . . . 74.02 111.496 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -83.83 -19.05 35.62 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.646 0.61 . . . . 64.31 112.646 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 38.9 tt0 -49.17 -55.3 12.85 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.298 0.481 . . . . 64.32 112.298 -174.081 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -52.17 -34.78 46.5 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.904 0.383 . . . . 61.34 112.0 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.47 -42.39 59.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.87 0.367 . . . . 72.43 111.719 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -69.87 -34.36 73.48 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.12 0.415 . . . . 73.32 112.12 -178.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 84.0 mm-40 -51.04 -38.24 50.24 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.084 0.469 . . . . 71.14 111.322 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.508 ' HA2' HH11 ' A' ' 64' ' ' ARG . . . -58.67 -33.0 70.62 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.01 -0.541 . . . . 75.42 113.861 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.486 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 71.0 mtm -90.05 -45.31 9.24 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.293 -0.533 . . . . 75.32 111.717 178.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.22 -29.52 61.11 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.517 0.562 . . . . 65.02 112.517 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.508 HH11 ' HA2' ' A' ' 61' ' ' GLY . 18.3 ptt-85 -65.24 -19.0 65.76 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.748 0.309 . . . . 63.12 111.737 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.0 3.46 8.69 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.881 0.697 . . . . 64.25 112.881 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 62' ' ' MET . 82.5 mt -90.25 -77.32 0.4 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.904 0.335 . . . . 73.02 111.904 178.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 52.52 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.654 0.74 . . . . 73.43 112.49 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.53 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -77.86 99.12 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 115.62 -0.718 . . . . 62.44 110.532 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.86 -9.87 16.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.961 -0.563 . . . . 72.55 112.194 -176.992 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.46 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -157.46 173.75 16.43 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.845 0.355 . . . . 61.5 111.431 173.266 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -56.53 -39.67 73.77 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.16 0.8 . . . . 62.3 113.16 -171.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -54.34 -34.46 61.1 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.739 0.304 . . . . 52.03 111.344 -177.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.53 ' HB2' HG23 ' A' ' 68' ' ' ILE . 49.3 m-20 -63.39 -46.25 87.31 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.025 0.441 . . . . 60.11 110.849 176.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 80.3 t -58.28 -46.07 89.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.378 0.608 . . . . 73.22 110.512 176.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 6.6 mtpm? -64.16 -28.0 69.46 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.765 -0.652 . . . . 75.5 110.915 177.546 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 55.4 m -73.03 -36.36 66.95 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.897 0.379 . . . . 42.3 110.789 174.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -61.72 -37.09 82.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.482 -0.326 . . . . 72.42 110.896 175.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 t -52.78 -39.52 62.35 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.188 0.518 . . . . 71.53 111.135 176.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -62.6 -38.78 91.53 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.926 -0.579 . . . . 72.42 110.896 177.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.71 -42.89 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.876 0.369 . . . . 73.33 110.74 175.087 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 20.7 mmt -54.96 -40.98 70.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.017 -0.538 . . . . 74.34 111.256 178.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.2 -43.05 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.091 -0.504 . . . . 72.11 111.013 175.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -67.06 -28.77 68.47 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.087 -0.506 . . . . 70.03 112.064 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 91.8 t -55.46 -35.05 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.112 0.482 . . . . 55.42 111.366 177.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.532 ' HA ' ' NH2' ' A' ' 94' ' ' ARG . 73.8 m-85 . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 112.128 0.418 . . . . 64.3 112.128 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.459 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 94.0 m95 . . . . . 0 N--CA 1.473 0.702 0 N-CA-C 111.875 0.324 . . . . 73.32 111.875 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.74 -24.59 49.12 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.276 -0.488 . . . . 73.0 112.999 174.673 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.532 ' NH2' ' HA ' ' A' ' 85' ' ' PHE . 73.1 mtp180 -66.65 -43.04 85.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.938 0.399 . . . . 74.15 110.452 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.72 -43.44 95.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.217 0.532 . . . . 74.25 110.297 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.1 t -60.54 -42.71 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.929 -0.578 . . . . 54.32 110.959 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.9 m -60.87 -42.56 98.13 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.93 0.395 . . . . 63.34 111.162 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 27.0 tp -59.66 -54.64 44.1 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.263 0.554 . . . . 73.35 111.515 177.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 13' ' ' ILE . 59.4 mt -69.1 -37.84 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-N 116.073 -0.512 . . . . 72.05 111.746 -177.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.5 p -65.6 -40.37 92.6 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.33 -0.231 . . . . 55.32 111.311 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -62.22 -42.3 99.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.666 0.27 . . . . 65.34 110.506 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.76 -47.2 87.44 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.914 -0.66 . . . . 44.55 112.219 174.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 107' ' ' LYS . . . -66.42 -34.65 78.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.946 0.403 . . . . 50.22 111.582 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -64.87 -45.51 85.7 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.044 0.449 . . . . 73.54 110.679 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.75 -37.49 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 116.335 -0.393 . . . . 63.31 110.584 175.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.74 -40.85 66.49 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.793 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 93.7 mttt -57.28 -49.36 76.34 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.111 0.482 . . . . 75.2 110.651 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.438 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.5 t60 -64.68 -33.2 75.39 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.103 -0.499 . . . . 72.43 110.996 178.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.508 HD21 ' HB ' ' A' ' 68' ' ' ILE . 76.6 mt -62.95 -50.78 69.47 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.619 -0.264 . . . . 73.34 111.44 177.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.6 tttm -65.39 -27.41 68.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.984 0.421 . . . . 70.41 110.609 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.1 m -65.66 -31.67 72.82 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.115 -0.493 . . . . 73.44 111.382 175.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.8 pt -108.77 36.34 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-O 120.777 0.322 . . . . 73.3 111.455 177.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 p30 47.7 20.41 0.2 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.225 1.194 . . . . 51.4 114.225 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.17 35.71 0.81 Allowed 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.203 0.525 . . . . 74.53 110.879 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -56.69 -39.24 73.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.008 -0.542 . . . . 73.34 112.105 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 79.1 p -65.37 -27.63 68.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.491 -0.322 . . . . 55.25 111.643 178.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.5 m -68.57 -26.4 65.38 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.545 0.338 . . . . 74.1 111.81 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.23 -40.78 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 N-CA-C 112.62 0.6 . . . . 60.32 112.62 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.95 -52.52 23.87 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 112.852 0.686 . . . . 51.42 112.852 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.14 -27.14 84.27 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.88 1.72 . . . . 64.45 112.159 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.65 -46.36 82.86 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 109.831 -0.433 . . . . 64.41 109.831 172.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.56 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.07 -39.4 78.43 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.02 0.438 . . . . 61.15 111.132 174.379 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.62 -43.17 97.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.405 -0.361 . . . . 64.0 110.943 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.2 m -58.71 -47.47 84.44 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.886 0.374 . . . . 72.34 111.015 177.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.8 mm -52.7 -52.51 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.44 0.638 . . . . 63.41 111.087 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.8 m -67.04 -38.41 85.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.421 -0.809 . . . . 70.35 112.261 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.406 ' HA ' ' HE2' ' A' ' 6' ' ' TYR . 30.1 t70 -64.07 -51.15 65.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.674 0.273 . . . . 65.33 110.889 -178.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 67.0 t -60.4 -33.85 55.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.371 0.605 . . . . 65.42 110.944 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.546 ' HG ' HD11 ' A' ' 137' ' ' LEU . 38.8 tp -66.12 -54.04 30.52 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.999 -0.546 . . . . 74.53 111.917 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.447 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 61.5 t -76.49 -29.63 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 111.941 0.349 . . . . 65.2 111.941 -176.093 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.56 -49.94 66.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.989 0.423 . . . . 63.21 112.122 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.532 ' OG1' ' HD3' ' A' ' 133' ' ' LYS . 10.5 p -109.99 -39.23 5.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 75.32 112.402 -175.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.532 ' HD3' ' OG1' ' A' ' 132' ' ' THR . 2.7 mppt? -82.46 10.79 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.294 0.479 . . . . 72.34 112.294 -177.351 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 20.9 tpt180 -45.71 -61.24 1.79 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.849 0.685 . . . . 64.33 112.849 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.05 -49.06 79.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.071 0.462 . . . . 64.34 111.363 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -60.68 -36.93 79.97 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.156 -0.475 . . . . 72.41 111.996 -177.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.546 HD11 ' HG ' ' A' ' 129' ' ' LEU . 29.7 mt -59.35 -54.48 46.26 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.685 0.254 . . . . 73.22 111.685 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.8 p -71.11 -38.44 71.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 112.027 0.38 . . . . 54.15 112.027 -178.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -63.12 -46.02 89.27 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.122 0.416 . . . . 72.12 112.122 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -94.65 6.23 49.48 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.995 0.426 . . . . 73.43 111.317 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 62.05 26.63 16.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.92 -0.582 . . . . 63.45 112.281 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.459 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 25.83 -83.09 0.0 OUTLIER Glycine 0 N--CA 1.468 0.787 0 N-CA-C 115.903 1.121 . . . . 73.32 115.903 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.402 ' O ' HG23 ' A' ' 147' ' ' VAL . 12.5 m95 -75.34 -38.17 60.31 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.124 0.416 . . . . 62.02 112.124 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 20.0 m-20 -64.69 -48.08 76.01 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.922 -0.399 . . . . 75.53 109.922 173.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.53 93.19 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.148 -0.549 . . . . 64.44 112.492 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.05 -49.34 74.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.921 0.488 . . . . 71.43 111.164 174.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.512 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.5 t -68.89 -35.96 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 116.351 -0.386 . . . . 61.22 111.281 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 46.0 mt-10 -57.5 -47.54 81.65 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.088 0.47 . . . . 54.44 111.154 176.22 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -60.04 -48.96 79.53 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.077 -0.511 . . . . 75.44 111.728 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -83.94 -3.63 58.1 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.157 0.428 . . . . 74.22 112.157 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.4 p80 44.59 86.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.92 1.082 . . . . 72.14 113.92 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.536 HG21 ' OG1' ' A' ' 43' ' ' THR . 81.8 t . . . . . 0 N--CA 1.472 0.628 0 CA-C-O 121.219 0.533 . . . . 74.11 110.691 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 113.194 0.813 . . . . 62.21 113.194 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -49.82 -47.57 51.33 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.334 -0.848 . . . . 74.31 111.61 175.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.456 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.3 tp -69.54 -36.54 76.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.815 -0.63 . . . . 74.34 111.413 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -68.12 -44.56 75.85 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.236 -0.438 . . . . 73.22 111.297 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.608 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 24.8 mmm180 -71.94 -32.77 67.66 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.224 0.453 . . . . 63.32 112.224 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -64.16 -51.85 61.83 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.146 0.498 . . . . 73.45 111.07 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 p -61.68 -54.51 41.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.093 -0.503 . . . . 73.41 111.673 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.519 HD23 HH11 ' A' ' 7' ' ' ARG . 50.6 tp -54.35 -37.96 65.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.444 -0.344 . . . . 64.42 111.832 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.608 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 1.9 tm-20 -60.28 -53.43 57.79 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.263 0.554 . . . . 73.21 111.273 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.449 HD13 ' HB3' ' A' ' 40' ' ' ALA . 65.0 mt -63.5 -47.76 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.811 -0.631 . . . . 75.52 111.342 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.6 mt -61.64 -51.42 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.04 -0.527 . . . . 75.5 111.623 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -52.13 -50.05 62.47 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.05 0.452 . . . . 52.32 111.733 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.565 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 66.7 mtt-85 -62.78 -42.02 99.51 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.859 -0.337 . . . . 70.23 111.657 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -57.6 -44.08 85.16 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.38 . . . . 73.55 111.613 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.2 mp -56.84 -44.38 82.04 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.965 0.412 . . . . 72.22 110.571 174.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -66.52 -32.72 74.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.319 -0.4 . . . . 74.12 111.996 175.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 8.6 mm-40 -62.35 -41.99 99.04 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.354 0.597 . . . . 74.23 110.645 177.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -78.46 -30.67 47.53 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.636 -0.711 . . . . 73.5 112.207 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.32 -38.69 71.7 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.937 0.398 . . . . 74.43 111.739 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 63.6 p -87.05 -36.21 18.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.766 0.317 . . . . 64.31 111.715 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.638 0 C-N-CA 121.06 -0.591 . . . . 71.14 111.966 -173.853 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 113.953 0.341 . . . . 73.21 113.953 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -51.09 -42.55 60.68 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.62 0.6 . . . . 74.14 112.62 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.5 m -54.86 -36.89 65.56 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.257 0.465 . . . . 64.25 112.257 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.3 p -69.77 -38.82 76.87 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.789 0.328 . . . . 74.43 110.81 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -61.62 -55.08 34.55 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.895 0.378 . . . . 73.42 111.365 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 20.6 mtpp -55.09 -45.18 75.41 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.001 -0.545 . . . . 61.41 110.875 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB3' HD13 ' A' ' 12' ' ' ILE . . . -60.48 -44.59 95.76 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.312 -0.404 . . . . 74.32 111.547 176.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.2 -54.46 40.63 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.336 0.495 . . . . 71.42 112.336 -177.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.47 -22.37 63.64 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.995 -0.441 . . . . 63.21 111.864 -177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.54 HG23 HG21 ' A' ' 152' ' ' VAL . 61.3 m -73.5 -40.44 64.07 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 122.233 -0.292 . . . . 74.23 110.526 171.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 40' ' ' ALA . 42.3 mt -55.37 -42.34 73.79 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.058 0.392 . . . . 51.21 112.058 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.49 ' NH2' ' HB3' ' A' ' 19' ' ' GLU . 1.1 ptp85 -74.16 -36.05 64.06 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.007 -0.433 . . . . 74.23 111.865 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -63.41 -44.62 94.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.777 0.322 . . . . 73.33 111.664 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 51' ' ' VAL . 25.6 m -87.85 -33.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.813 0.339 . . . . 64.45 111.699 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.97 -29.97 72.35 Favored Glycine 0 CA--C 1.523 0.587 0 CA-C-N 116.308 -0.406 . . . . 63.11 113.265 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 12.3 t70 -51.19 -58.02 7.25 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.955 0.407 . . . . 74.13 110.968 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.02 -45.37 95.72 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.052 -0.594 . . . . 73.23 113.038 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 47' ' ' VAL . 95.0 t -56.8 -44.86 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 122.493 -0.416 . . . . 72.11 111.742 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 48.7 mt-30 -64.73 -38.65 91.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.855 0.317 . . . . 74.52 111.855 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 79.6 mtt-85 -61.67 -37.93 85.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.114 -0.366 . . . . 72.41 111.756 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -77.15 -46.0 24.88 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.006 0.431 . . . . 74.24 111.48 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -76.78 -21.21 55.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.033 0.753 . . . . 75.32 113.033 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -50.4 -55.01 17.62 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 112.265 0.469 . . . . 74.11 112.265 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -57.34 -27.69 62.46 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 120.867 0.365 . . . . 75.15 111.85 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.54 -47.15 13.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.454 -0.339 . . . . 72.25 111.724 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.92 -30.97 70.52 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.015 0.376 . . . . 74.22 112.015 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -52.21 -36.84 53.25 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.835 0.35 . . . . 75.11 111.195 174.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.68 -29.56 64.4 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.082 -0.508 . . . . 41.3 113.167 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.467 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 63.2 mtm -90.62 -43.88 9.89 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 122.412 -0.463 . . . . 75.55 111.658 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HG22 ' A' ' 105' ' ' VAL . 8.2 mp -58.87 -32.98 69.97 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.348 0.499 . . . . 75.03 112.348 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -60.96 -12.61 11.89 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.645 0.609 . . . . 74.11 112.645 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.21 5.98 9.15 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.522 0.564 . . . . 72.11 112.522 179.089 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 62' ' ' MET . 79.3 mt -88.73 -83.47 0.22 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.319 0.489 . . . . 51.45 112.319 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 49.56 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.488 0.661 . . . . 63.34 112.529 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -82.37 120.4 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.692 -0.686 . . . . 52.2 111.239 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.2 -14.39 15.86 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.234 0.457 . . . . 72.22 112.234 178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -164.93 178.72 6.92 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.308 0.575 . . . . 74.41 112.282 173.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -48.8 -40.48 29.29 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.288 0.847 . . . . 73.12 113.288 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -58.31 -35.41 71.8 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 111.769 0.285 . . . . 74.2 111.769 -175.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.548 ' HB2' HG23 ' A' ' 68' ' ' ILE . 25.3 m-20 -67.8 -41.38 83.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.249 0.547 . . . . 65.13 110.627 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 87.8 t -56.01 -42.95 73.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 115.892 -0.595 . . . . 73.22 111.019 177.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.04 -31.47 72.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.912 -0.586 . . . . 74.43 111.525 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 t -64.86 -37.49 87.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.13 0.49 . . . . 74.23 110.675 176.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.406 ' O ' ' HG2' ' A' ' 81' ' ' MET . 90.3 mt -59.83 -31.94 70.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.231 -0.441 . . . . 73.41 111.268 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.2 t -57.8 -36.77 72.67 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.109 0.48 . . . . 61.2 111.173 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -64.3 -40.98 97.04 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.267 -0.424 . . . . 73.13 110.656 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.01 -43.89 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 120.947 0.403 . . . . 71.41 110.527 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.478 ' HB2' HG21 ' A' ' 128' ' ' VAL . 20.0 mmt -55.49 -38.67 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.201 0.524 . . . . 45.04 111.233 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 74.6 mt -61.06 -41.56 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.024 -0.535 . . . . 74.41 111.18 175.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -66.05 -28.55 68.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.511 -0.313 . . . . 74.04 111.533 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 86.8 t -61.65 -35.65 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 111.777 0.288 . . . . 71.22 111.777 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.579 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 20.7 m-85 . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 112.414 0.524 . . . . 75.23 112.414 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.477 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.7 m95 . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 112.403 0.52 . . . . 72.2 112.403 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.73 -25.99 45.46 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.993 -0.622 . . . . 32.54 112.654 174.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -67.24 -40.22 86.3 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.064 0.459 . . . . 74.05 110.531 175.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.404 HG13 ' CE3' ' A' ' 92' ' ' TRP . 40.4 mm -63.7 -43.31 98.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 116.074 -0.512 . . . . 75.0 110.062 174.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.8 t -58.85 -42.42 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.894 -0.594 . . . . 70.32 110.568 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.2 m -58.66 -43.77 89.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.938 0.399 . . . . 75.42 111.278 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.579 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 32.5 tp -61.46 -55.11 34.83 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.243 0.544 . . . . 63.44 111.593 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.0 mt -66.84 -40.68 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 116.13 -0.486 . . . . 55.53 111.717 -176.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 99.9 p -64.32 -44.05 92.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.63 -0.259 . . . . 64.31 111.172 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -60.8 -42.27 97.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.595 0.236 . . . . 74.23 110.994 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.66 90.41 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 120.727 -0.749 . . . . 65.24 112.193 174.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.79 -29.53 69.5 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.105 0.478 . . . . 73.13 111.597 176.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -68.17 -47.26 68.47 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.256 -0.429 . . . . 74.34 110.647 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.417 HG22 HD11 ' A' ' 63' ' ' LEU . 53.8 t -64.89 -35.9 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.428 -0.351 . . . . 63.11 110.43 175.383 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.87 -43.12 69.31 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.176 -0.466 . . . . 71.01 111.453 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.429 ' NZ ' ' OE1' ' A' ' 52' ' ' GLN . 52.7 mttp -57.09 -45.92 82.97 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.265 0.555 . . . . 72.5 110.721 174.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' HIS . . . . . 0.402 ' O ' HG12 ' A' ' 112' ' ' ILE . 78.4 t60 -64.04 -33.63 76.17 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.938 -0.574 . . . . 72.41 111.307 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.34 -49.92 67.55 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.567 -0.288 . . . . 63.0 111.108 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -58.08 -38.42 76.37 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.981 0.419 . . . . 72.33 110.796 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.2 m -57.54 -35.04 69.78 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.055 -0.52 . . . . 71.44 111.531 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.9 pt -106.32 31.86 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 120.96 0.41 . . . . 71.55 111.149 176.204 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.8 p30 48.94 21.73 0.49 Allowed 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.959 1.096 . . . . 75.24 113.959 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -90.62 35.88 0.89 Allowed 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.998 -0.439 . . . . 63.21 111.371 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -44.91 69.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.9 0.333 . . . . 71.25 111.9 -177.319 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.4 m -57.28 -27.89 62.52 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.075 0.398 . . . . 73.12 112.075 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.6 m -65.41 -25.82 67.71 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.882 0.373 . . . . 71.11 111.835 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -53.95 -40.76 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.628 0.603 . . . . 75.41 112.628 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.57 -52.56 26.48 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.379 0.511 . . . . 73.31 112.379 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -59.15 -24.97 76.27 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 121.704 1.602 . . . . 53.52 112.308 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.58 -46.64 68.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.69 -0.485 . . . . 70.04 109.69 173.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.6 -39.21 79.75 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.291 -0.413 . . . . 72.51 111.174 174.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -57.33 -44.92 84.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.38 -0.373 . . . . 74.44 110.706 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 58.8 m -62.37 -45.13 94.56 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.373 -0.376 . . . . 73.24 111.572 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.432 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.9 mm -54.11 -53.35 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-O 121.44 0.638 . . . . 63.23 110.836 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' THR . . . . . 0.408 HG21 ' HB2' ' A' ' 10' ' ' LEU . 41.1 m -67.4 -36.39 81.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.521 -0.763 . . . . 61.34 111.704 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.7 t70 -59.93 -51.45 69.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.801 0.334 . . . . 43.3 110.598 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 81' ' ' MET . 57.8 t -64.95 -41.87 93.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.049 0.452 . . . . 73.45 111.122 177.035 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.511 ' HG ' HD11 ' A' ' 137' ' ' LEU . 52.3 tp -54.41 -53.14 58.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.067 -0.515 . . . . 62.54 111.462 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.506 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 94.9 t -73.52 -33.1 38.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.187 -0.46 . . . . 74.35 111.415 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 24.9 tpt180 -48.58 -46.71 39.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.842 0.457 . . . . 74.12 111.917 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -114.13 -28.56 7.27 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.739 1.014 . . . . 64.34 113.739 -175.807 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.594 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.5 mptp? -109.5 20.46 18.16 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.409 0.892 . . . . 64.13 113.409 -177.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 18.7 ttt180 -52.8 -53.91 41.6 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.261 0.467 . . . . 70.33 112.261 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -68.27 -40.0 82.01 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 111.866 0.321 . . . . 72.03 111.866 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -60.54 -41.39 94.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.631 0.253 . . . . 73.52 111.601 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.0 mt -54.84 -55.5 29.68 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.554 -0.294 . . . . 72.1 111.756 178.163 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -68.85 -41.12 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 112.218 0.451 . . . . 71.35 112.218 -178.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 66.5 mmtt -64.4 -39.36 93.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.52 0.563 . . . . 63.43 112.52 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -98.26 8.31 45.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.939 0.4 . . . . 74.52 111.411 178.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 45.0 mtt180 60.41 22.73 12.3 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.012 -0.54 . . . . 70.35 112.184 178.236 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLY . . . . . 0.477 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 20.82 -82.23 0.0 OUTLIER Glycine 0 C--N 1.34 0.8 0 N-CA-C 116.177 1.231 . . . . 72.2 116.177 176.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.425 ' O ' HG23 ' A' ' 147' ' ' VAL . 37.4 m95 -74.87 -41.8 59.12 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.815 0.302 . . . . 71.43 111.815 -172.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 9.8 m-20 -62.66 -46.21 89.27 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.468 . . . . 73.22 110.08 174.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.99 -31.1 77.07 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.969 -0.559 . . . . 73.52 112.537 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -59.55 -51.74 68.56 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.099 0.559 . . . . 74.02 110.976 176.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.6 t -59.65 -39.24 79.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 115.813 -0.631 . . . . 74.3 111.514 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -73.49 -35.66 65.69 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.238 0.459 . . . . 73.12 112.238 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -62.86 -49.04 76.45 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.925 0.393 . . . . 65.45 111.473 -177.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -82.95 -16.15 48.48 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.452 -0.34 . . . . 73.01 111.237 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 83.1 t60 61.33 78.76 0.27 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.493 0.664 . . . . 72.43 112.017 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.54 HG21 HG23 ' A' ' 43' ' ' THR . 69.3 t . . . . . 0 N--CA 1.47 0.528 0 CA-C-N 115.888 -0.596 . . . . 73.35 111.737 -178.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 1' ' ' MET . 26.5 ttt . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 121.06 0.457 . . . . 61.45 111.044 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -114.11 177.04 4.78 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.499 0.666 . . . . 75.53 112.242 -174.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -103.78 163.51 12.29 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.503 -0.771 . . . . 71.14 110.394 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -57.28 -45.83 83.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.3 0.571 . . . . 63.42 110.843 175.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 69.5 tp -59.84 -38.88 83.32 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.716 -0.675 . . . . 71.42 111.089 175.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.25 -44.55 91.46 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.112 -0.494 . . . . 63.12 110.941 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mmm180 -63.49 -43.62 96.73 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.004 0.372 . . . . 74.33 112.004 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.43 ' O ' HG13 ' A' ' 12' ' ' ILE . 50.5 tt0 -60.62 -52.36 65.48 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.906 0.384 . . . . 75.32 111.35 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 p -61.6 -44.3 97.26 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.316 -0.402 . . . . 72.41 111.2 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.0 tp -54.83 -44.89 74.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.082 -0.508 . . . . 73.44 111.62 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 9.9 tp10 -61.95 -49.85 74.48 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.797 0.332 . . . . 74.5 111.166 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 8' ' ' GLN . 66.6 mt -54.84 -52.68 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.228 0.537 . . . . 74.43 111.106 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 99' ' ' ILE . 81.5 mt -64.78 -41.42 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.723 -0.671 . . . . 74.41 111.392 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -56.49 -46.29 80.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.339 -0.391 . . . . 63.42 111.418 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.561 ' NH1' ' SD ' ' A' ' 30' ' ' MET . 62.5 mtp180 -61.89 -53.89 49.52 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.455 -0.339 . . . . 75.12 111.159 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.65 -42.02 67.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.821 0.343 . . . . 75.44 111.859 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.486 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.5 mp -65.69 -42.53 91.13 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.973 0.36 . . . . 71.12 111.973 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -66.84 -40.16 87.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 122.2 -0.312 . . . . 71.31 111.594 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 45.6 mt-10 -61.73 -50.61 71.71 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.108 0.48 . . . . 51.34 111.026 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.431 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 27.3 mm-40 -59.66 -40.01 86.33 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.206 -0.452 . . . . 64.12 111.714 176.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -64.62 -42.55 95.43 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.035 0.445 . . . . 74.02 111.847 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' HE2' ' A' ' 110' ' ' LYS . 69.4 p -87.49 -7.25 57.84 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.253 -0.43 . . . . 71.14 112.039 -176.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 25.31 73.44 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 121.193 -0.527 . . . . 72.43 113.379 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -152.58 174.78 13.52 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 122.514 0.326 . . . . 62.44 110.775 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -90.24 148.17 23.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.008 0.433 . . . . 73.44 111.585 179.189 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.83 165.73 13.11 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 116.201 -0.454 . . . . 62.14 111.833 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -108.93 -17.21 13.98 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.57 0.952 . . . . 73.34 113.57 -173.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.413 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 51.6 mtpt -55.38 154.47 11.68 Favored Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 112.808 0.67 . . . . 61.31 112.808 -176.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -70.63 175.59 8.6 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.629 2.219 . . . . 42.23 111.722 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.561 ' SD ' ' NH1' ' A' ' 15' ' ' ARG . 75.9 mmm -92.51 146.03 23.99 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.214 0.53 . . . . 73.34 112.038 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -72.98 125.87 10.02 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 114.547 0.579 . . . . 74.53 114.547 -175.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 tpt180 60.98 -80.43 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.029 0.751 . . . . 65.35 113.029 172.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.8 m -82.12 108.27 15.46 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.66 0.267 . . . . 32.22 111.401 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.36 -57.4 18.73 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 114.28 0.472 . . . . 71.22 114.28 -176.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.04 -49.95 14.19 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 122.615 -0.344 . . . . 72.21 111.855 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.8 m -55.15 -48.27 73.95 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.152 0.427 . . . . 65.32 112.152 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.515 ' HB2' ' HB3' ' A' ' 30' ' ' MET . 61.2 m -68.01 -34.67 76.95 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.701 0.286 . . . . 73.2 111.503 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -63.58 -54.92 28.45 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.733 0.301 . . . . 61.34 111.449 176.314 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 18.5 ptmt -63.39 -36.85 85.1 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.844 0.355 . . . . 72.33 111.144 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.464 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -62.99 -46.79 86.04 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.656 0.265 . . . . 63.23 111.424 176.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.3 tp -61.06 -50.65 72.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.255 0.465 . . . . 74.52 112.255 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.8 pt-20 -64.8 -35.89 82.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 122.136 -0.353 . . . . 65.25 111.675 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.591 ' O ' HG22 ' A' ' 47' ' ' VAL . 53.6 m -65.96 -47.32 75.02 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.713 0.292 . . . . 72.14 110.695 174.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.3 mt -53.95 -49.43 68.73 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.229 0.455 . . . . 72.42 112.229 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 45' ' ' ARG . 10.7 ptm180 -66.43 -41.62 88.92 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.116 0.413 . . . . 65.01 112.116 -176.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -70.32 -42.99 71.23 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.152 0.427 . . . . 73.23 112.152 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 43' ' ' THR . 25.4 m -82.78 -33.48 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 122.035 -0.416 . . . . 74.33 111.427 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -62.11 -40.8 99.42 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.453 -0.403 . . . . 63.31 112.675 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 17.4 t70 -55.82 -47.69 76.75 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.971 0.415 . . . . 53.33 110.921 174.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.05 -44.21 96.44 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.972 -0.632 . . . . 75.21 112.63 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.5 t -57.89 -44.36 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-O 120.742 0.306 . . . . 74.31 111.063 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 76.8 mt-30 -60.33 -42.65 96.09 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.598 -0.273 . . . . 65.51 111.373 176.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.1 mmm180 -55.2 -52.66 62.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 111.975 0.361 . . . . 74.42 111.975 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -75.33 -33.21 61.11 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.16 0.43 . . . . 71.22 112.16 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -90.91 -17.62 26.13 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.765 1.024 . . . . 74.13 113.765 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -48.72 -50.25 34.39 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 118.163 0.438 . . . . 74.34 112.163 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.2 t -55.92 -31.09 62.59 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.046 0.388 . . . . 71.32 112.046 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.63 -48.61 11.52 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.38 -0.373 . . . . 52.25 111.692 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -58.55 -47.12 85.3 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.487 -0.324 . . . . 72.44 111.703 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -52.38 -30.4 28.81 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.877 0.37 . . . . 75.34 111.758 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.16 -39.99 95.16 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.285 -0.483 . . . . 51.22 113.017 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.0 mtm -90.6 -34.71 15.37 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.269 0.557 . . . . 71.42 110.575 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -58.56 -36.87 74.6 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.955 -0.566 . . . . 71.12 111.596 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -60.11 -39.43 86.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.222 -0.445 . . . . 71.43 111.849 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 -9.78 43.03 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 111.814 0.301 . . . . 75.43 111.814 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.1 mt -82.2 -76.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.656 0.265 . . . . 75.35 110.61 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 47.21 91.89 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.527 0.731 . . . . 74.51 112.321 -178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -76.68 110.12 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.243 0.545 . . . . 70.31 112.019 -175.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.16 -6.92 22.68 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.037 -0.528 . . . . 75.14 112.094 178.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -165.12 169.73 15.82 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.748 0.309 . . . . 73.04 111.521 173.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -54.31 -32.09 55.65 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.546 0.573 . . . . 63.22 112.546 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.35 -35.14 67.3 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.869 0.366 . . . . 73.04 111.729 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.3 m-20 -68.92 -35.52 76.92 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.02 0.438 . . . . 70.02 110.454 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.84 -41.1 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.218 0.532 . . . . 54.2 110.519 175.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -59.07 -32.16 69.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.034 -0.53 . . . . 64.11 110.856 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -72.13 -40.26 68.23 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.144 -0.48 . . . . 64.1 110.801 174.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.1 mt -56.49 -33.68 66.21 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.558 -0.292 . . . . 74.1 111.007 176.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.432 ' O ' HG13 ' A' ' 82' ' ' ILE . 28.8 t -51.75 -42.18 62.14 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.299 -0.41 . . . . 74.53 111.494 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.93 -43.04 99.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.896 0.379 . . . . 72.5 111.063 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 84' ' ' VAL . 79.8 t -63.52 -44.19 98.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 120.948 0.404 . . . . 65.25 110.745 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -55.73 -39.23 70.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.975 -0.557 . . . . 75.22 111.625 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 78' ' ' SER . 76.5 mt -62.11 -44.36 98.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-O 121.175 0.512 . . . . 71.15 111.165 175.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 57.9 m80 -65.0 -27.9 69.14 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.395 -0.366 . . . . 60.15 111.955 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 80' ' ' VAL . 66.8 t -58.66 -20.99 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.807 0.337 . . . . 61.12 111.672 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 37.7 m-85 -106.43 -4.34 19.99 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.352 0.501 . . . . 74.03 112.352 177.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.2 t -70.49 5.44 1.81 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.791 0.663 . . . . 60.31 112.791 -174.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.273 0.472 . . . . 63.33 112.273 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.43 -44.29 3.17 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.077 -0.582 . . . . 75.45 113.328 -178.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.408 ' O ' ' NH2' ' A' ' 94' ' ' ARG . 34.1 m -62.85 -177.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.448 0.536 . . . . 72.14 112.448 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 74.0 p -87.0 -78.99 0.28 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 122.115 -0.366 . . . . 65.22 111.17 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 45.41 89.58 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.728 1.01 . . . . 74.21 113.728 176.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.472 ' CE3' HG13 ' A' ' 95' ' ' ILE . 96.8 m95 -60.28 -20.38 58.88 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.837 0.351 . . . . 72.33 111.234 173.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.03 -28.5 61.11 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 121.244 -0.503 . . . . 72.02 112.893 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.408 ' NH2' ' O ' ' A' ' 89' ' ' VAL . 64.3 mtm180 -70.17 -34.53 73.1 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.547 -0.384 . . . . 72.32 111.173 176.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.472 HG13 ' CE3' ' A' ' 92' ' ' TRP . 29.0 mm -58.13 -45.98 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.601 0.715 . . . . 74.55 109.437 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.76 -44.72 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 115.248 -0.887 . . . . 64.55 111.085 174.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.5 m -61.43 -35.71 78.32 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.292 -0.413 . . . . 62.33 111.344 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.502 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 22.8 tp -62.77 -55.31 27.68 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.34 0.59 . . . . 72.14 110.952 176.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 56.3 mt -67.11 -35.24 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.862 -0.608 . . . . 44.21 111.377 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.0 t -65.52 -47.08 77.17 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.004 -0.544 . . . . 53.25 111.19 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.3 t80 -62.99 -39.82 95.92 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.748 0.308 . . . . 63.24 110.593 176.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.7 -46.13 89.73 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.856 -0.688 . . . . 65.42 112.274 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.878 0.37 . . . . 74.31 111.547 176.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.13 -39.34 94.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.978 0.418 . . . . 75.44 111.017 178.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 101' ' ' PHE . 40.6 t -75.09 -38.97 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 120.941 0.4 . . . . 70.34 110.64 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.76 82.87 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.42 0.526 . . . . 75.11 112.42 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 18.3 ptpt -62.46 -34.89 77.71 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.76 0.314 . . . . 63.4 111.006 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.425 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -65.72 -37.69 87.11 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.853 0.358 . . . . 71.04 110.505 173.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.533 HD21 ' HB ' ' A' ' 68' ' ' ILE . 87.6 mt -61.78 -50.28 72.97 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.367 -0.379 . . . . 75.23 111.609 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 66.4 tttp -63.02 -35.64 80.91 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.994 -0.441 . . . . 74.22 110.79 177.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 85.0 m -56.19 -41.67 75.91 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.928 0.394 . . . . 74.5 110.846 175.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.5 pt -97.97 20.4 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 112.08 0.4 . . . . 74.33 112.08 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 71.78 3.45 4.67 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.561 0.948 . . . . 72.52 113.561 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -84.82 45.55 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.601 0.593 . . . . 61.24 112.601 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.58 -34.25 76.6 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.117 0.414 . . . . 74.22 112.117 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.4 m -58.88 -26.52 64.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.821 0.343 . . . . 73.2 111.49 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -77.83 -27.52 49.96 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.551 -0.295 . . . . 72.4 111.714 178.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.7 mt -57.68 -46.27 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.622 0.601 . . . . 63.54 112.622 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.84 -52.05 44.11 Favored Pre-proline 0 CA--C 1.55 0.943 0 N-CA-C 112.577 0.584 . . . . 74.2 112.577 -174.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.15 -27.45 84.91 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.802 1.668 . . . . 74.43 112.134 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -64.71 -48.0 76.26 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.711 -0.477 . . . . 72.22 109.711 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.486 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.04 -39.97 72.8 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.001 0.429 . . . . 72.32 111.031 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.09 -36.89 85.51 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.214 -0.448 . . . . 73.11 111.061 174.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -64.42 -43.18 95.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 120.79 0.329 . . . . 74.34 111.209 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.3 mm -56.52 -52.92 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.27 0.557 . . . . 71.3 110.57 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 m -64.54 -35.17 80.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.76 -0.654 . . . . 65.23 111.39 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 13.7 t70 -60.33 -52.74 63.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.37 -0.377 . . . . 74.2 111.197 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.472 ' O ' HG22 ' A' ' 132' ' ' THR . 66.5 t -64.27 -42.04 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 121.027 0.441 . . . . 62.12 110.791 177.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.1 tp -54.27 -52.87 60.03 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.866 -0.607 . . . . 74.34 111.257 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 85.0 t -74.85 -23.85 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 115.958 -0.564 . . . . 74.32 111.85 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 48.7 ttm-85 -70.17 -46.79 63.91 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.092 0.404 . . . . 73.53 112.092 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 133' ' ' LYS . 8.0 t -108.26 -34.99 6.66 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.373 0.879 . . . . 75.3 113.373 -176.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HG2' HG23 ' A' ' 132' ' ' THR . 75.5 mmtt -99.39 18.66 17.18 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.938 -0.477 . . . . 75.21 112.017 -177.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 9.0 tpt180 -46.32 -61.71 1.67 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.101 0.56 . . . . 45.15 112.481 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -62.48 -41.41 98.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.927 -0.578 . . . . 73.14 111.985 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -59.55 -38.31 80.74 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.797 0.332 . . . . 54.14 111.509 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.7 mt -56.62 -51.15 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.395 -0.366 . . . . 73.33 111.919 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.7 p -78.16 -43.6 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 63.41 112.383 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -61.13 -50.5 72.97 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.216 0.451 . . . . 70.1 112.216 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -94.08 9.84 36.09 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.014 0.435 . . . . 74.04 111.057 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 143' ' ' TRP . 48.0 mtm180 58.89 25.58 13.84 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.74 -0.664 . . . . 75.11 111.745 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 24.53 -79.78 0.0 OUTLIER Glycine 0 N--CA 1.471 1.013 0 N-CA-C 115.562 0.985 . . . . 61.24 115.562 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 40' ' ' ALA . 31.4 m95 -70.83 -46.08 63.38 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.805 0.336 . . . . 70.34 111.678 -176.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 11.3 m-20 -61.78 -40.49 95.37 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.2 0.524 . . . . 74.23 110.218 175.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.99 -31.17 67.06 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.847 -0.615 . . . . 62.42 112.705 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -63.54 -46.37 86.31 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.108 0.563 . . . . 71.33 111.613 178.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.583 HG13 ' HB ' ' A' ' 152' ' ' VAL . 96.7 t -67.44 -36.26 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 112.33 0.493 . . . . 53.34 112.33 -178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.737 ' HA ' ' HB2' ' A' ' 154' ' ' ASP . 12.6 pt-20 -74.01 -38.04 64.21 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 122.204 -0.31 . . . . 71.34 111.157 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.96 -48.14 83.2 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.824 0.345 . . . . 73.42 111.453 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -82.5 -1.59 50.9 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.058 0.392 . . . . 72.5 112.058 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.627 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 32.2 t60 56.65 72.48 0.5 Allowed 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.47 0.545 . . . . 73.51 112.47 175.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 147' ' ' VAL . 97.6 t -103.16 -68.52 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 122.256 -0.278 . . . . 71.34 110.866 174.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -95.46 9.23 40.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.283 0.563 . . . . 72.02 110.578 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.737 ' HB2' ' HA ' ' A' ' 148' ' ' GLU . 17.6 t70 -81.38 156.88 25.22 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.983 -0.553 . . . . 71.14 111.747 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.539 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -137.19 5.95 2.8 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.089 -0.505 . . . . 52.14 111.43 178.627 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.486 ' HG3' HD22 ' A' ' 155' ' ' LEU . 41.3 mt-10 -105.58 -62.64 1.33 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.411 -0.359 . . . . 74.44 111.196 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 161.0 -33.85 0.39 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.955 -0.64 . . . . 62.51 113.62 -177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 74.83 -39.01 1.1 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 121.452 -0.404 . . . . 73.24 114.063 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -75.48 119.68 19.88 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.563 -0.375 . . . . 70.15 111.889 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -154.16 57.73 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.29 0.566 . . . . 63.54 110.842 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -67.1 122.15 17.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.951 -0.568 . . . . 60.05 112.441 -176.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -134.77 119.54 18.32 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.275 -0.42 . . . . 73.31 110.717 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -104.83 139.35 39.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.886 0.374 . . . . 53.04 111.469 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 118.857 -0.592 . . . . 71.13 111.033 176.777 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.282 0.563 . . . . 52.33 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -155.39 154.16 31.55 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.876 -0.602 . . . . 61.51 111.621 -173.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 m-20 -69.68 148.08 49.74 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.912 -0.586 . . . . 73.42 111.597 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.544 ' HG2' ' HD3' ' A' ' 32' ' ' ARG . 8.7 tp10 -65.21 -30.82 71.75 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.495 0.664 . . . . 63.53 109.262 171.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 137' ' ' LEU . 57.0 tp -55.37 -43.82 75.48 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.454 -0.794 . . . . 73.11 110.669 170.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 58.8 t80 -60.54 -47.51 85.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.541 -0.754 . . . . 74.12 111.314 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -71.36 -31.34 67.22 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.077 0.399 . . . . 72.53 112.077 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 41.0 tt0 -65.61 -53.34 43.03 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.169 0.509 . . . . 64.34 110.58 175.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 p -61.08 -42.47 98.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.808 -0.633 . . . . 53.22 110.961 178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 tp -55.33 -47.69 75.29 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.022 -0.536 . . . . 74.33 112.047 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.94 -41.46 91.29 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.798 0.332 . . . . 74.43 111.082 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLN . 81.6 mt -59.04 -54.14 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.108 0.48 . . . . 74.25 111.074 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' LEU . 80.8 mt -61.76 -44.95 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.02 -0.537 . . . . 74.24 111.235 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.3 t -54.83 -46.6 74.63 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.772 0.32 . . . . 71.42 111.365 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.549 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 9.9 mtp180 -57.96 -58.02 10.26 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.698 0.285 . . . . 64.01 110.963 175.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.409 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 59.2 t80 -53.68 -44.72 69.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.029 -0.532 . . . . 75.52 111.991 -174.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.0 mp -59.95 -45.98 90.91 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.539 -0.3 . . . . 74.51 111.556 177.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.447 ' HG3' HH11 ' A' ' 18' ' ' ARG . 39.5 mmm-85 -65.91 -43.88 86.87 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.777 0.323 . . . . 73.41 111.399 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.549 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 42.1 mt-10 -63.26 -41.95 99.09 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.892 0.377 . . . . 44.15 111.489 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -71.43 -40.62 70.29 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.8 0.333 . . . . 73.23 111.735 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.92 97.6 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.963 0.411 . . . . 74.11 111.723 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.9 p -89.04 -16.16 32.31 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.259 0.466 . . . . 52.3 112.259 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.05 27.45 72.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.957 -0.639 . . . . 72.51 112.465 -176.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.24 -156.62 0.69 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.66 0.384 . . . . 61.31 111.188 -175.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -107.92 146.01 32.99 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.885 0.374 . . . . 73.11 111.682 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -88.44 153.59 21.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.492 -0.322 . . . . 72.04 111.327 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.7 t -89.14 -16.59 31.08 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.506 0.928 . . . . 61.23 113.506 -173.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -61.78 150.42 82.3 Favored Pre-proline 0 N--CA 1.471 0.614 0 O-C-N 122.169 -0.332 . . . . 65.32 111.533 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.464 ' O ' ' HB2' ' A' ' 30' ' ' MET . 16.1 Cg_endo -58.23 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 122.659 2.239 . . . . 71.22 113.531 -173.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.561 ' SD ' ' HA ' ' A' ' 38' ' ' ARG . 5.6 tpt 174.63 -30.75 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.964 0.411 . . . . 74.33 111.563 -177.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.74 162.19 11.83 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.295 -0.478 . . . . 60.41 112.702 -178.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.544 ' HD3' ' HG2' ' A' ' 4' ' ' GLU . 56.4 ttt85 -54.6 -46.85 73.87 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.695 0.628 . . . . 73.41 112.695 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.8 m -65.03 -16.86 63.91 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.512 0.56 . . . . 75.34 112.512 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 59.55 -91.47 0.04 OUTLIER Glycine 0 CA--C 1.528 0.861 0 N-CA-C 114.286 0.475 . . . . 65.22 114.286 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.578 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -60.43 -50.83 72.03 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.063 0.394 . . . . 55.11 112.063 -176.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.3 m -58.82 -38.82 79.51 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.98 0.419 . . . . 74.31 111.477 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.8 p -73.24 -39.07 65.76 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.535 -0.302 . . . . 53.32 111.505 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.561 ' HA ' ' SD ' ' A' ' 30' ' ' MET . 11.9 ttt180 -59.54 -54.58 44.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.808 0.337 . . . . 74.52 111.265 174.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 22.5 mtpp -55.33 -41.59 72.65 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.055 -0.521 . . . . 64.3 110.894 -177.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.23 82.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.237 -0.438 . . . . 45.2 111.465 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.04 -53.12 60.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.126 0.417 . . . . 73.02 112.126 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -66.51 -21.37 66.17 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.173 -0.33 . . . . 72.22 111.829 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 47' ' ' VAL . 97.4 m -77.5 -42.31 36.14 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.807 0.337 . . . . 54.24 110.265 170.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.25 -40.79 71.35 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.375 -0.375 . . . . 72.52 111.72 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.409 ' HA ' ' HE1' ' A' ' 16' ' ' TYR . 5.7 ptm180 -72.65 -37.63 67.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.055 -0.403 . . . . 64.21 111.231 178.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -66.91 -44.89 79.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.993 0.425 . . . . 63.23 111.68 -178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 51' ' ' VAL . 18.7 m -90.94 -33.65 5.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 120.891 0.377 . . . . 75.21 111.533 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.25 -47.16 83.23 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 116.076 -0.511 . . . . 71.41 113.902 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 13.7 t70 -51.71 -53.31 40.67 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 117.472 0.636 . . . . 62.1 110.621 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.88 -46.48 90.49 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.994 -0.548 . . . . 64.41 113.112 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.0 t -57.62 -42.21 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 O-C-N 122.786 -0.244 . . . . 71.35 111.033 177.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.3 mt-30 -59.32 -53.39 58.78 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.586 -0.279 . . . . 73.12 110.982 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 9.0 mmm180 -58.33 -41.24 84.16 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.738 0.304 . . . . 73.1 111.756 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -71.42 -46.05 61.12 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.289 0.566 . . . . 72.13 111.685 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -80.16 -17.53 52.19 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.858 -0.61 . . . . 74.51 112.479 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 38.0 tt0 -48.18 -54.82 12.1 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.863 0.69 . . . . 73.44 112.863 -172.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.97 -31.55 67.0 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.902 0.382 . . . . 73.43 111.843 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.7 -36.24 60.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.842 0.353 . . . . 75.05 111.542 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -76.06 -31.76 58.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.947 0.351 . . . . 72.23 111.947 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -48.35 -39.58 22.56 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.855 0.36 . . . . 70.31 111.776 178.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.46 -37.95 61.61 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 116.052 -0.522 . . . . 74.55 113.761 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.474 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 56.9 mtm -90.45 -38.96 12.92 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.119 -0.636 . . . . 64.13 110.506 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.5 tp -54.49 -43.85 72.13 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.871 -0.604 . . . . 65.12 111.868 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -57.22 -30.18 64.37 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.811 0.671 . . . . 63.23 112.811 -177.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' A' ' 62' ' ' MET . 19.0 pttp -101.26 4.82 42.12 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.866 0.365 . . . . 50.04 111.854 -177.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.4 mt -99.94 -69.57 0.76 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.704 0.288 . . . . 75.51 110.868 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 71.7 -48.63 0.68 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.479 0.918 . . . . 72.52 113.479 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.442 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.6 mp 62.97 98.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.571 0.7 . . . . 74.25 111.476 -174.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -102.15 -9.56 20.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.226 -0.443 . . . . 74.11 111.863 -179.332 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -163.12 177.55 9.01 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.459 0.541 . . . . 62.32 112.459 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.58 -41.85 54.93 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.847 0.684 . . . . 74.44 112.847 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.78 -39.38 68.33 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.659 0.266 . . . . 63.11 111.309 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.92 -41.93 95.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.197 0.523 . . . . 74.14 110.836 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.8 t -57.59 -48.06 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.26 0.552 . . . . 61.44 110.939 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.7 -26.24 65.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.311 -0.404 . . . . 74.15 111.321 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.0 t -65.73 -39.34 91.04 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.064 0.459 . . . . 52.21 110.682 172.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 81' ' ' MET . 92.0 mt -59.14 -35.44 73.49 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.266 -0.425 . . . . 75.35 111.075 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.437 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.2 t -52.58 -40.43 62.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.916 0.388 . . . . 71.45 111.383 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -53.55 -35.97 61.33 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.287 -0.415 . . . . 72.12 111.46 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 58.2 t -82.72 -39.13 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.015 0.436 . . . . 75.12 111.183 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.454 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.4 mmt -54.37 -37.49 65.04 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.114 0.483 . . . . 71.41 111.366 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 78' ' ' SER . 74.7 mt -59.28 -40.03 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 116.22 -0.445 . . . . 42.32 111.518 175.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -66.62 -32.02 73.08 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 120.767 0.318 . . . . 74.34 111.474 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.3 t -57.39 -29.42 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-O 120.991 0.424 . . . . 74.24 111.542 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.463 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 25.2 m-85 -91.58 23.43 3.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.727 0.639 . . . . 71.24 112.727 178.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.5 t -51.96 -33.87 39.68 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.026 0.38 . . . . 65.34 112.026 178.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.436 ' HB3' HG22 ' A' ' 89' ' ' VAL . 1.3 m-20 -72.47 131.68 42.88 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.33 0.586 . . . . 73.3 112.107 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.02 17.88 51.08 Favored Glycine 0 CA--C 1.526 0.72 0 CA-C-N 115.911 -0.586 . . . . 42.44 111.937 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.436 HG22 ' HB3' ' A' ' 87' ' ' ASP . 28.4 m -105.87 -178.21 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.03 0.532 . . . . 43.33 111.893 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 164' ' ' HIS . 14.6 t -77.38 20.57 0.29 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.078 0.77 . . . . 73.12 113.078 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -68.57 81.0 0.27 Allowed 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.664 -0.648 . . . . 61.52 111.411 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.34 -16.47 60.5 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.076 -0.511 . . . . 74.11 111.411 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.86 -24.74 50.66 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.078 -0.582 . . . . 71.31 112.763 173.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -64.46 -39.08 93.13 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.641 -0.329 . . . . 74.23 110.767 174.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.9 mm -59.35 -48.68 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.336 0.589 . . . . 74.12 110.118 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.45 -46.88 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 115.541 -0.754 . . . . 61.05 110.988 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.5 m -59.26 -48.81 80.21 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.328 -0.396 . . . . 73.25 111.655 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.505 ' HG ' HG23 ' A' ' 125' ' ' ILE . 33.0 tp -56.59 -54.53 44.9 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.221 0.534 . . . . 71.12 111.485 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 53.5 mt -67.74 -32.99 59.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 116.018 -0.537 . . . . 73.22 111.148 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.2 t -60.48 -51.7 68.35 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.257 -0.429 . . . . 75.13 111.291 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 105' ' ' VAL . 28.4 t80 -64.42 -37.76 88.64 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.604 -0.271 . . . . 75.35 110.782 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -48.99 78.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.872 -0.68 . . . . 43.34 112.572 175.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.442 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.62 -35.99 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.109 0.481 . . . . 64.44 111.259 176.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.562 ' CE2' HD22 ' A' ' 63' ' ' LEU . 47.4 t80 -62.46 -44.2 96.98 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.045 -0.525 . . . . 64.42 111.115 178.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 101' ' ' PHE . 55.9 t -66.87 -37.53 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 120.824 0.345 . . . . 52.44 110.471 175.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.66 -38.54 72.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.237 -0.438 . . . . 61.34 111.655 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.6 -45.05 93.06 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.104 0.478 . . . . 74.04 110.734 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.45 ' O ' HG12 ' A' ' 112' ' ' ILE . 82.4 t60 -64.6 -39.95 94.63 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.212 -0.449 . . . . 71.03 110.704 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.23 -49.26 78.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.358 -0.383 . . . . 71.42 111.564 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -59.99 -44.13 94.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.095 0.474 . . . . 54.24 110.466 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.8 m -56.7 -45.09 82.04 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.113 -0.494 . . . . 75.34 111.706 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 108' ' ' HIS . 35.7 pt -87.15 12.66 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-O 120.92 0.391 . . . . 71.23 111.773 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 67.99 16.58 9.56 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.041 0.756 . . . . 61.3 113.041 174.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -92.74 38.86 1.03 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.83 0.348 . . . . 73.32 110.942 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.24 -32.95 67.08 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.083 0.401 . . . . 61.05 112.083 -176.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.5 p -56.26 -38.34 71.03 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.847 0.356 . . . . 74.55 111.704 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.5 m -61.96 -26.74 68.38 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.68 0.622 . . . . 75.43 112.68 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 18' ' ' ARG . 65.8 mt -54.5 -45.36 70.57 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 112.874 0.694 . . . . 74.32 112.874 -176.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.32 -52.71 35.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 112.44 0.533 . . . . 54.23 112.44 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -26.11 81.66 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.75 1.633 . . . . 52.22 112.262 173.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.6 tt -66.16 -44.39 84.22 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.635 -0.505 . . . . 75.21 109.635 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.3 -37.67 75.54 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.219 -0.446 . . . . 70.45 110.896 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.05 -39.3 94.32 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.562 -0.29 . . . . 62.32 111.414 174.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.7 m -63.15 -45.71 90.63 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.016 0.436 . . . . 70.04 110.986 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.6 mm -56.58 -52.78 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.297 0.57 . . . . 62.31 110.794 175.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.6 m -65.91 -34.81 78.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.804 -0.635 . . . . 72.3 111.974 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 20.3 t70 -63.14 -50.27 71.08 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.458 -0.337 . . . . 71.52 110.53 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.7 t -63.05 -39.82 86.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.053 0.454 . . . . 51.2 111.084 176.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.53 ' HG ' HD11 ' A' ' 137' ' ' LEU . 60.1 tp -53.28 -53.12 55.44 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.185 0.517 . . . . 70.21 111.338 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.514 ' HA ' ' HB3' ' A' ' 134' ' ' ARG . 42.0 t -73.6 -31.15 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 CA-C-N 116.038 -0.528 . . . . 43.34 111.756 177.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.7 tpt180 -52.54 -42.42 64.4 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.212 0.605 . . . . 61.41 112.389 -176.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.697 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.6 t -126.16 -21.67 4.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.723 1.009 . . . . 75.44 113.723 -175.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 132' ' ' THR . 32.5 mmtp -122.67 13.27 10.01 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.293 0.849 . . . . 73.42 113.293 -173.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 0.2 OUTLIER -60.26 -40.46 90.43 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.537 0.684 . . . . 73.33 110.913 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 134' ' ' ARG . 33.0 t70 -59.44 -50.63 73.2 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.146 -0.934 . . . . 53.44 110.803 177.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -59.05 -36.83 75.71 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.739 0.304 . . . . 64.23 111.549 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.53 HD11 ' HG ' ' A' ' 129' ' ' LEU . 88.1 mt -57.91 -49.33 77.1 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.436 -0.347 . . . . 73.11 111.791 176.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.8 p -77.6 -31.98 17.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 112.041 0.386 . . . . 55.1 112.041 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.4 mmtt -64.34 -58.58 6.09 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.08 0.466 . . . . 74.44 111.813 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -91.73 -1.32 57.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.089 0.403 . . . . 73.51 112.089 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 59.84 80.83 0.19 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.248 0.547 . . . . 65.43 110.242 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -55.31 -50.75 58.34 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.474 -0.784 . . . . 71.11 114.352 -171.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.44 ' O ' HG23 ' A' ' 147' ' ' VAL . 26.1 m95 -73.84 -36.27 64.89 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 117.014 0.407 . . . . 71.24 111.903 -175.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.22 -51.67 65.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.487 0.661 . . . . 61.43 110.741 174.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.07 -31.66 78.44 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.486 -0.779 . . . . 51.11 113.101 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.89 -45.21 82.71 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.118 0.485 . . . . 71.12 111.288 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 143' ' ' TRP . 48.2 t -65.61 -46.01 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.96 -0.564 . . . . 61.54 112.168 -178.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -27.73 61.24 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.101 0.408 . . . . 71.0 112.101 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -57.3 -49.1 77.19 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.215 0.531 . . . . 72.32 110.953 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -83.66 -0.3 50.09 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.263 -0.426 . . . . 71.43 111.472 173.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 19.3 t60 60.17 37.73 20.58 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.335 0.654 . . . . 73.15 112.055 175.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.468 HG12 ' HG3' ' A' ' 153' ' ' GLU . 60.0 t -76.23 -69.69 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-O 120.873 0.368 . . . . 71.12 110.922 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.468 ' HG3' HG12 ' A' ' 152' ' ' VAL . 53.4 mt-10 -125.34 61.86 1.2 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.085 0.469 . . . . 70.45 111.284 177.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.38 144.38 53.42 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.245 -0.434 . . . . 65.23 111.139 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.487 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -107.51 -7.65 16.48 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.789 0.328 . . . . 64.3 111.583 179.587 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 62.31 2.72 0.9 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.588 0.958 . . . . 71.34 113.588 173.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' GLY . . . . . 0.433 ' H ' HD23 ' A' ' 155' ' ' LEU . . . -77.84 66.87 3.02 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 121.164 -0.541 . . . . 74.41 112.572 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 71.46 -151.26 48.01 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 121.399 -0.429 . . . . 71.51 113.547 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 69.86 -61.7 0.44 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.795 0.838 . . . . 64.11 113.026 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -44.42 103.86 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.124 1.157 . . . . 71.43 114.124 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -142.19 96.61 2.99 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.351 -0.84 . . . . 71.44 110.036 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -83.05 71.99 10.11 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.286 0.565 . . . . 64.32 111.853 -175.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -86.31 113.45 22.31 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.175 -0.466 . . . . 72.22 110.865 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.468 ' HA ' HG22 ' A' ' 90' ' ' THR . 40.3 t-80 . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.735 -0.65 . . . . 73.54 112.354 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 mmt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.963 0.411 . . . . 63.35 110.217 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.774 ' HG3' ' HD3' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -163.39 166.5 22.8 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.018 0.437 . . . . 75.13 112.075 -172.514 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 4.0 p30 -121.43 178.38 4.82 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 116.181 -0.463 . . . . 54.4 111.209 176.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.42 -46.08 91.28 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.385 0.513 . . . . 72.24 112.385 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.584 HD23 ' HG3' ' A' ' 134' ' ' ARG . 65.0 tp -61.28 -42.74 99.16 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.08 0.467 . . . . 73.45 110.628 -179.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -56.42 -45.29 80.78 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.764 -0.653 . . . . 72.41 111.037 174.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.774 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 25.3 mmm180 -66.71 -48.47 69.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.127 0.417 . . . . 75.41 112.127 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.416 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.6 tt0 -62.1 -51.4 68.06 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.063 0.459 . . . . 73.34 110.964 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.2 p -57.13 -37.74 72.44 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.04 0.447 . . . . 75.33 110.627 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.567 HD11 ' HG2' ' A' ' 123' ' ' GLU . 44.1 tp -60.09 -46.04 90.93 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.919 -0.582 . . . . 62.44 111.993 178.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.9 pt-20 -67.09 -40.76 87.01 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 120.452 -0.499 . . . . 71.11 110.939 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.44 ' N ' ' HG3' ' A' ' 11' ' ' GLU . 66.3 mt -57.21 -53.6 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.158 0.504 . . . . 72.25 110.964 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.468 HG23 HG23 ' A' ' 99' ' ' ILE . 84.3 mt -66.91 -45.69 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 115.852 -0.613 . . . . 61.01 111.502 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 27.7 t -56.52 -53.94 51.66 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.406 -0.361 . . . . 71.44 111.416 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.643 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 40.3 mtt180 -55.95 -49.75 72.67 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.305 -0.257 . . . . 74.44 110.305 176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.477 ' CD2' HG22 ' A' ' 99' ' ' ILE . 62.7 t80 -52.54 -44.91 66.09 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.994 0.368 . . . . 71.51 111.994 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.561 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.8 mp -60.66 -40.83 93.51 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.371 -0.205 . . . . 74.43 111.21 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 31.3 mmm-85 -64.63 -42.41 95.51 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.952 0.406 . . . . 70.13 110.876 177.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 4.7 mm-40 -56.66 -49.94 73.55 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.594 0.712 . . . . 64.13 110.881 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -75.43 -30.8 60.15 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.702 -0.681 . . . . 73.12 112.463 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -38.14 73.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.021 0.439 . . . . 65.14 111.637 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.3 p -87.69 -36.97 17.1 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.233 -0.439 . . . . 73.32 111.231 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.95 -0.8 59.2 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-N 116.28 -0.418 . . . . 71.0 112.517 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.06 -159.89 0.7 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 122.601 0.361 . . . . 73.24 111.408 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HD2' ' NH2' ' A' ' 45' ' ' ARG . 29.0 mtmm -131.43 149.71 52.43 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.064 0.459 . . . . 65.03 111.734 176.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -77.84 159.39 29.0 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.112 -0.494 . . . . 65.45 110.826 170.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.3 t -134.96 9.18 3.54 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.987 0.422 . . . . 65.21 111.368 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -83.98 153.69 63.68 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-O 120.712 0.291 . . . . 64.12 111.538 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -50.8 151.18 11.42 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.899 2.4 . . . . 64.45 113.679 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.561 ' HA ' ' NH2' ' A' ' 15' ' ' ARG . 4.2 tpt -80.01 165.68 22.33 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 116.236 -0.438 . . . . 75.41 110.628 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.35 -86.42 0.16 Allowed Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.309 -0.472 . . . . 52.42 113.092 -178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -104.87 -76.85 0.59 Allowed 'General case' 0 N--CA 1.472 0.646 0 O-C-N 122.314 -0.521 . . . . 63.24 111.575 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 t -75.25 121.68 22.53 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.161 0.505 . . . . 73.03 110.818 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -86.84 -50.48 3.71 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.822 -0.627 . . . . 74.43 113.487 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.582 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -74.84 -52.21 11.97 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.405 0.521 . . . . 52.52 112.405 -174.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.1 m -59.13 -51.34 70.45 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 120.947 0.403 . . . . 71.4 111.443 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.7 m -60.48 -32.69 71.66 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.337 -0.392 . . . . 70.22 111.65 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -69.14 -48.64 61.83 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.017 0.436 . . . . 73.11 110.881 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 26.3 mtpp -56.59 -48.37 77.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.427 0.632 . . . . 70.42 110.667 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.71 77.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.758 -0.655 . . . . 73.42 111.9 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -54.8 -52.84 61.38 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.297 0.48 . . . . 70.04 112.297 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.41 -42.25 98.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.671 0.272 . . . . 61.25 111.366 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.494 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -63.95 -35.45 80.74 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.755 -0.202 . . . . 64.02 111.484 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 41.6 mt -53.91 -52.11 61.59 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.625 0.25 . . . . 74.32 111.673 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.441 ' NH2' ' HD2' ' A' ' 25' ' ' LYS . 15.9 ptt180 -77.24 -29.36 53.99 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.198 -0.314 . . . . 74.42 111.758 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.41 ' NH1' HG11 ' A' ' 152' ' ' VAL . 42.2 ttm180 -61.54 -44.45 97.02 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.421 -0.354 . . . . 72.03 111.56 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 43' ' ' THR . 22.3 m -93.78 -33.27 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.143 0.497 . . . . 73.02 111.135 176.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -56.82 -59.48 10.75 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.706 -0.679 . . . . 53.33 113.271 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.553 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 24.6 t70 -53.12 -34.01 54.86 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 117.322 0.561 . . . . 53.44 111.406 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.3 -49.33 75.45 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.216 -0.516 . . . . 44.32 112.598 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.62 -37.07 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-O 120.817 0.341 . . . . 72.41 111.464 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 28.6 mt-30 -56.92 -52.1 66.49 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.398 -0.365 . . . . 75.3 111.263 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 34.6 mmm-85 -62.09 -27.95 69.28 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.987 0.365 . . . . 64.03 111.987 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-20 -72.05 -41.95 66.84 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.373 0.606 . . . . 74.12 110.763 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -85.19 -15.67 42.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.499 -0.773 . . . . 52.44 112.582 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 52' ' ' GLN . 43.3 tt0 -47.32 -44.98 24.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.305 0.642 . . . . 74.21 112.717 -170.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.6 t -55.55 -42.56 74.81 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.952 0.406 . . . . 62.13 111.737 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.86 -48.28 32.25 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.795 0.331 . . . . 51.01 111.794 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -57.49 -44.11 84.69 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.559 -0.291 . . . . 72.12 111.749 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -55.01 -39.65 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.121 0.486 . . . . 75.41 110.835 174.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -63.77 -28.74 73.07 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-N 116.055 -0.521 . . . . 55.01 112.787 176.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 82.7 mtp -79.09 -47.98 15.15 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.094 0.473 . . . . 74.21 110.687 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.63 -34.84 73.3 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.294 0.479 . . . . 72.41 112.294 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.0 ptt180 -67.79 -16.7 64.24 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 111.968 0.359 . . . . 62.41 111.968 -178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 11.27 22.49 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.087 0.47 . . . . 71.45 111.161 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 -73.66 0.64 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.026 -0.534 . . . . 63.53 111.221 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 70.45 -43.86 0.56 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 113.766 1.024 . . . . 73.12 113.766 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.451 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.5 mp 62.83 90.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.445 0.64 . . . . 64.15 111.026 -174.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -12.6 33.13 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.975 -0.557 . . . . 75.42 111.935 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 17.2 p-10 -159.23 175.28 13.61 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.359 0.599 . . . . 73.12 112.274 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.08 -35.26 69.17 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.678 -0.692 . . . . 63.41 112.71 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -62.58 -29.2 70.42 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.279 0.474 . . . . 75.22 112.279 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -66.68 -41.45 88.08 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.076 0.465 . . . . 62.55 110.144 174.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.3 t -57.37 -39.95 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.017 -0.538 . . . . 64.23 110.525 174.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -59.17 -42.05 89.88 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.168 0.509 . . . . 63.12 110.628 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.5 t -67.8 -35.83 79.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.028 -0.533 . . . . 72.4 111.745 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -55.78 -30.63 61.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.658 0.266 . . . . 74.02 111.523 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 82' ' ' ILE . 22.6 t -52.94 -37.41 60.95 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.009 0.433 . . . . 74.12 111.131 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -59.69 -49.11 79.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.112 0.482 . . . . 70.12 111.104 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.28 -41.46 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.97 -0.559 . . . . 65.44 110.996 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.403 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.4 mmt -58.04 -37.78 75.02 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.951 -0.568 . . . . 63.35 111.464 178.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' SER . 80.1 mt -63.42 -38.12 81.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 120.845 0.355 . . . . 72.32 111.045 173.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 35.7 m80 -62.23 -33.42 74.55 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.669 0.271 . . . . 73.53 111.613 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.534 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 95.7 t -56.27 -34.64 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-O 120.988 0.423 . . . . 74.21 111.442 177.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 74.2 m-85 -85.78 10.21 14.3 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.563 0.579 . . . . 72.41 112.563 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.3 t -68.67 -46.92 67.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.958 0.409 . . . . 72.13 111.494 177.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.656 ' HB2' ' HD2' ' A' ' 94' ' ' ARG . 3.7 m-20 -62.38 116.45 5.08 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.124 -0.489 . . . . 75.1 111.758 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.44 61.44 2.76 Favored Glycine 0 CA--C 1.529 0.965 0 C-N-CA 121.477 -0.392 . . . . 74.41 113.06 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 59.6 t -74.35 -17.63 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.653 0.381 . . . . 52.15 111.982 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 35.1 p 63.58 -62.11 0.15 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.237 1.015 . . . . 71.21 111.971 -174.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -55.64 159.82 2.79 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.329 0.585 . . . . 71.42 112.519 176.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -69.24 11.32 0.23 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.182 0.808 . . . . 73.13 113.182 -175.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.78 -37.76 70.5 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 121.189 -0.529 . . . . 74.04 113.061 177.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.656 ' HD2' ' HB2' ' A' ' 87' ' ' ASP . 3.7 mmp_? -61.6 -36.78 81.66 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.77 0.319 . . . . 71.23 111.781 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.01 -44.89 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.121 0.486 . . . . 74.03 110.723 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -58.41 -49.64 81.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.037 -0.529 . . . . 74.22 111.055 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.4 m -57.05 -47.66 80.42 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.796 0.331 . . . . 71.41 111.49 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.492 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 31.6 tp -58.65 -55.77 30.85 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.193 0.52 . . . . 62.44 112.068 -178.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.477 HG22 ' CD2' ' A' ' 16' ' ' TYR . 41.4 mt -70.46 -34.82 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 116.188 -0.46 . . . . 71.43 111.587 -174.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.5 m -66.54 -41.9 88.01 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.764 -0.198 . . . . 73.44 111.38 177.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.437 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.7 t80 -62.16 -43.8 98.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.705 0.288 . . . . 63.32 110.691 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.98 -45.57 86.47 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.891 -0.671 . . . . 70.13 112.375 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.549 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.83 -33.78 76.36 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.844 0.354 . . . . 73.21 111.816 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -65.61 -43.27 90.09 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.96 0.41 . . . . 71.21 110.54 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 101' ' ' PHE . 48.9 t -65.91 -38.47 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-O 120.851 0.358 . . . . 65.12 110.439 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.63 -41.2 69.76 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.185 -0.462 . . . . 64.21 111.865 177.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -54.34 -48.91 70.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.528 0.68 . . . . 71.32 110.619 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.471 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.4 t60 -67.05 -39.71 86.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.76 -0.655 . . . . 74.22 111.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -58.65 -50.14 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.737 0.303 . . . . 65.41 111.331 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.57 -45.95 90.33 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.084 0.469 . . . . 72.13 111.035 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 63.2 m -55.68 -40.23 72.02 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.937 -0.574 . . . . 43.14 112.231 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.4 pt -96.57 21.2 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.507 0.558 . . . . 64.21 112.507 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 69.16 10.43 7.84 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.832 0.679 . . . . 65.2 112.832 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -92.12 27.45 2.17 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.024 0.44 . . . . 73.22 110.589 175.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.514 ' HG3' HD12 ' A' ' 118' ' ' ILE . 70.8 tt0 -58.93 -34.86 72.21 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.342 0.497 . . . . 72.15 112.342 -174.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.9 m -56.92 -31.98 65.47 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.927 0.394 . . . . 75.52 111.195 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -64.74 -26.37 68.33 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.396 0.517 . . . . 72.14 112.396 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.514 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.0 mt -53.67 -41.22 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 112.725 0.639 . . . . 72.54 112.725 -176.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.04 -54.64 9.44 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 112.403 0.519 . . . . 74.24 112.403 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.13 -29.34 86.93 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 121.712 1.608 . . . . 75.13 112.263 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.7 tt -65.01 -46.39 81.55 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.867 -0.42 . . . . 75.04 109.867 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.561 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.93 -40.78 77.01 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.206 -0.452 . . . . 74.13 110.819 173.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.567 ' HG2' HD11 ' A' ' 10' ' ' LEU . 42.1 mt-10 -63.98 -32.87 74.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.095 -0.502 . . . . 73.23 111.162 177.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.0 m -68.01 -38.64 82.84 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.59 0.234 . . . . 72.44 111.186 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -58.34 -53.27 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.227 0.537 . . . . 75.44 110.405 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 61.0 m -64.11 -35.15 79.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.838 -0.619 . . . . 64.44 111.203 176.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 23.3 t70 -59.97 -52.58 64.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.536 0.199 . . . . 72.21 111.536 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 96.3 t -63.65 -45.46 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.14 0.495 . . . . 63.45 110.651 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.553 ' HG ' HD11 ' A' ' 137' ' ' LEU . 46.4 tp -51.58 -52.13 49.83 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.785 -0.643 . . . . 75.54 111.079 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.543 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -69.36 -37.04 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.89 -0.595 . . . . 70.32 111.836 177.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.4 tpt180 -58.4 -35.89 72.71 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.17 -0.468 . . . . 72.03 112.151 -174.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.409 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.6 t -123.26 -16.74 6.82 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.365 0.876 . . . . 74.43 113.365 -177.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.409 ' HG2' HG23 ' A' ' 132' ' ' THR . 45.3 mmtm -132.39 16.49 4.48 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.965 1.098 . . . . 72.33 113.965 -172.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.584 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.7 ttp180 -60.33 -50.8 72.17 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.786 0.721 . . . . 75.15 111.304 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 30.7 t70 -55.64 -44.74 77.43 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.061 0.458 . . . . 75.02 110.653 177.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -63.34 -36.59 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.366 -0.379 . . . . 72.23 111.867 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.553 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.0 mt -57.0 -50.44 72.71 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.679 0.276 . . . . 72.44 111.275 174.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -77.8 -32.28 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 112.546 0.573 . . . . 74.33 112.546 -177.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.6 mmtt -72.36 -51.9 18.5 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.069 -0.395 . . . . 54.35 111.585 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -86.1 -9.33 56.89 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.467 -0.333 . . . . 73.41 111.762 -177.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mtt-85 61.61 60.16 1.69 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.403 0.621 . . . . 71.54 110.124 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -48.06 -49.62 23.62 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 115.1 -0.954 . . . . 53.22 115.354 -171.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -69.07 -43.19 75.08 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 117.428 0.614 . . . . 74.24 112.046 -174.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.5 -32.8 73.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.212 0.529 . . . . 64.54 110.83 174.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.52 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -74.3 -30.53 60.51 Favored Glycine 0 CA--C 1.525 0.66 0 CA-C-N 116.002 -0.544 . . . . 71.21 112.74 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -57.33 -42.94 82.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 71.42 111.133 177.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE3' ' A' ' 39' ' ' LYS . 30.8 t -68.03 -42.17 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 115.926 -0.579 . . . . 74.31 111.781 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.52 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.9 pt-20 -71.82 -32.1 67.23 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.655 0.264 . . . . 73.43 111.518 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.67 -49.36 78.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.853 0.359 . . . . 74.33 111.523 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -83.58 -1.8 54.64 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.819 0.303 . . . . 75.43 111.819 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.503 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 37.3 t60 59.66 21.91 10.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.741 0.416 . . . . 74.21 111.915 175.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.532 HG12 ' HG3' ' A' ' 153' ' ' GLU . 94.6 t -56.02 -61.93 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.976 0.417 . . . . 63.11 112.089 -176.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.532 ' HG3' HG12 ' A' ' 152' ' ' VAL . 52.8 mt-10 -115.94 27.75 9.08 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.399 0.619 . . . . 60.13 110.657 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.503 ' HB3' ' HA ' ' A' ' 151' ' ' HIS . 5.3 t70 -102.96 154.15 19.51 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.55 -0.75 . . . . 73.11 110.955 177.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -130.53 5.19 4.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.094 0.776 . . . . 75.44 113.094 -175.776 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -110.21 -41.13 4.5 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 112.442 0.534 . . . . 72.41 112.442 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 135.12 -12.72 4.4 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.462 -0.399 . . . . 41.41 112.624 -177.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 75.89 -145.76 32.87 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.262 -0.495 . . . . 54.31 113.15 -178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -42.7 107.64 0.08 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.265 0.555 . . . . 72.1 112.004 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -93.65 -10.01 35.97 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.401 -0.363 . . . . 72.23 111.562 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -154.43 121.53 5.63 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 120.961 0.41 . . . . 74.35 111.649 178.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -76.85 156.97 31.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.396 0.517 . . . . 70.43 112.396 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -157.8 139.76 14.14 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 72.34 111.027 175.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.7 p80 . . . . . 0 C--O 1.254 1.337 0 N-CA-C 112.321 0.489 . . . . 61.25 112.321 -178.624 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.617 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 121.117 0.484 . . . . 75.52 110.903 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.95 168.77 16.15 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.434 0.531 . . . . 54.31 112.434 -170.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.16 155.2 39.39 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.349 0.87 . . . . 73.44 113.349 -174.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.442 ' OE2' ' HD3' ' A' ' 32' ' ' ARG . 40.6 tt0 -56.48 -44.45 80.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.336 -0.847 . . . . 73.43 110.702 173.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 137' ' ' LEU . 60.0 tp -54.69 -43.71 72.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.838 -0.619 . . . . 65.34 111.782 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -68.31 -50.4 53.72 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.813 0.34 . . . . 72.04 111.365 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -63.55 -37.84 88.83 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.096 0.406 . . . . 71.34 112.096 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -69.44 -52.25 28.52 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.425 -0.352 . . . . 74.33 111.189 178.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -59.44 -51.86 68.08 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.716 0.293 . . . . 74.53 111.285 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.3 -45.0 65.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.284 -0.416 . . . . 74.31 111.689 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.554 ' HG2' ' HD2' ' A' ' 15' ' ' ARG . 28.2 tt0 -62.79 -51.56 66.62 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.72 0.295 . . . . 64.45 111.228 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' GLN . 72.0 mt -55.24 -48.76 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.072 0.463 . . . . 63.33 111.444 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.475 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.9 mt -64.04 -50.27 77.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 116.117 -0.492 . . . . 73.31 111.571 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 28.7 t -53.62 -54.23 40.57 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.812 0.339 . . . . 64.43 111.769 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.58 HH12 ' HA ' ' A' ' 30' ' ' MET . 55.0 mtp180 -58.06 -50.29 73.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.299 -0.409 . . . . 75.34 111.386 -178.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.64 -47.45 73.49 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.796 0.331 . . . . 70.34 111.444 177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 13' ' ' ILE . 8.3 mp -59.11 -45.45 90.87 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.781 0.289 . . . . 71.03 111.781 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.4 mmm180 -62.58 -53.06 60.22 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.652 0.263 . . . . 72.53 111.217 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 10.1 pt-20 -64.86 -35.02 79.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.832 0.349 . . . . 73.34 111.889 -178.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.553 ' HG2' ' HB1' ' A' ' 103' ' ' ALA . 8.1 tp-100 -69.5 -25.75 64.2 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.959 0.409 . . . . 73.2 111.121 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.71 -31.29 21.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.122 0.416 . . . . 71.33 112.122 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' ARG . 66.4 p -87.71 -37.75 16.41 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.191 0.441 . . . . 50.01 112.191 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.93 -6.94 57.04 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 116.216 -0.447 . . . . 65.25 112.379 -173.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -114.64 114.71 26.05 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.658 -0.319 . . . . 75.13 111.317 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.574 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -66.51 141.18 57.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.09 0.471 . . . . 74.12 112.068 -177.348 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -76.8 163.58 26.65 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-O 121.155 0.502 . . . . 74.43 112.191 -173.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.0 t -148.67 19.96 1.03 Allowed 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.96 0.726 . . . . 75.12 112.96 -176.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -69.64 162.89 64.22 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 122.063 -0.398 . . . . 62.13 111.696 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -51.89 133.15 44.83 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.297 1.998 . . . . 72.32 111.845 171.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.58 ' HA ' HH12 ' A' ' 15' ' ' ARG . 7.7 tpt -84.05 163.92 19.59 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.818 0.342 . . . . 74.24 111.701 -174.122 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.2 171.72 0.58 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 116.412 -0.358 . . . . 31.13 113.591 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.442 ' HD3' ' OE2' ' A' ' 4' ' ' GLU . 50.0 ttt-85 -44.18 -51.69 7.94 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.485 0.55 . . . . 75.42 112.485 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -73.07 117.96 15.44 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.772 0.32 . . . . 64.13 110.352 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.77 -81.91 0.68 Allowed Glycine 0 CA--C 1.526 0.777 0 C-N-CA 121.256 -0.497 . . . . 53.32 113.701 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.71 -50.36 60.67 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.572 0.582 . . . . 55.11 112.572 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.2 m -55.17 -51.62 65.92 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.125 0.417 . . . . 71.45 112.125 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.6 m -60.61 -42.44 96.81 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.921 0.341 . . . . 74.22 111.921 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.79 -42.08 96.86 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.046 0.451 . . . . 73.43 110.891 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -64.34 -43.64 93.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.892 -0.595 . . . . 70.2 111.408 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.51 -55.12 37.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.764 0.316 . . . . 71.01 111.538 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.2 tp -54.7 -41.68 70.57 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.204 0.526 . . . . 75.14 110.973 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -62.5 -47.14 85.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.818 -0.628 . . . . 72.51 111.479 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.577 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.2 m -61.87 -41.39 97.79 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.134 -0.484 . . . . 74.41 111.521 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.3 mt -53.6 -33.67 55.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.181 0.438 . . . . 71.01 112.181 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.526 ' HD3' ' OE2' ' A' ' 19' ' ' GLU . 42.7 mtm-85 -72.75 -55.29 6.98 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.855 0.317 . . . . 70.35 111.855 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -63.1 -37.19 86.23 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.819 0.674 . . . . 63.1 112.819 -176.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 43' ' ' THR . 15.5 m -91.96 -31.18 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 O-C-N 122.052 -0.405 . . . . 70.21 111.948 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.52 -43.78 85.32 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 121.291 -0.48 . . . . 42.23 114.061 -175.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -51.7 -53.5 38.52 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 117.0 0.4 . . . . 64.02 111.977 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.82 -46.74 74.98 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 121.105 -0.569 . . . . 70.43 112.864 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.6 t -58.46 -49.16 83.15 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 120.818 0.342 . . . . 53.24 111.117 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -57.12 -44.24 83.09 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.365 -0.38 . . . . 72.3 111.929 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -68.73 -51.07 45.37 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.331 0.493 . . . . 61.32 112.331 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -61.9 -36.81 82.43 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.412 0.625 . . . . 73.2 111.385 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.32 -16.67 57.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.501 -0.772 . . . . 74.33 112.988 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.32 -50.0 22.79 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.911 0.708 . . . . 72.12 112.911 -171.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.9 t -53.81 -40.43 66.36 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.859 0.361 . . . . 61.13 111.791 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.57 -41.33 60.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.724 0.297 . . . . 73.21 111.547 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -62.69 -47.58 83.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.402 -0.363 . . . . 65.12 111.535 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -53.11 -39.02 63.1 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.131 0.491 . . . . 72.03 110.993 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.53 -29.57 69.84 Favored Glycine 0 CA--C 1.528 0.845 0 CA-C-N 115.945 -0.571 . . . . 63.43 113.063 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 63.5 mtm -89.61 -42.11 11.59 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 122.379 -0.483 . . . . 73.44 111.596 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -55.09 -35.51 64.68 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.232 0.456 . . . . 70.21 112.232 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -63.56 -22.05 66.68 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 112.495 0.554 . . . . 74.04 112.495 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.426 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -108.2 10.58 27.86 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.424 0.631 . . . . 72.52 111.21 174.42 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 65' ' ' LYS . 91.6 mt -117.18 -76.18 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.775 -0.648 . . . . 62.04 110.274 175.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.9 t0 71.12 -40.72 0.48 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.287 1.035 . . . . 65.01 113.426 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.559 HD11 HD21 ' A' ' 77' ' ' LEU . 3.0 mp 60.42 94.25 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.975 0.91 . . . . 63.34 112.541 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.76 -10.1 17.66 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.201 -0.454 . . . . 74.34 111.165 176.631 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -158.73 169.58 24.07 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.39 -0.368 . . . . 72.15 111.252 175.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.52 -32.19 66.8 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.171 0.804 . . . . 73.14 113.171 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.21 -33.38 58.14 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.946 0.403 . . . . 74.51 111.722 177.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -71.46 -39.56 70.87 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.015 0.436 . . . . 70.3 110.458 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -58.67 -45.45 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.253 0.549 . . . . 74.15 110.805 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.59 -33.19 73.47 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.195 0.522 . . . . 61.23 111.077 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.6 m -69.21 -29.19 67.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.165 -0.47 . . . . 61.33 111.327 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 68' ' ' ILE . 94.0 mt -61.77 -35.39 77.99 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.78 0.324 . . . . 64.14 110.813 174.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -55.47 -39.2 70.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.064 0.459 . . . . 74.01 111.013 175.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -62.3 -41.55 98.61 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.238 -0.437 . . . . 73.43 110.706 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.434 ' O ' HG23 ' A' ' 84' ' ' VAL . 83.7 t -59.35 -43.51 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 120.928 0.394 . . . . 62.24 110.47 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.485 ' HB2' HG21 ' A' ' 128' ' ' VAL . 18.9 mmt -56.74 -43.61 80.89 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.994 -0.548 . . . . 75.1 111.16 177.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 69.6 mt -59.08 -34.5 53.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.183 0.516 . . . . 70.51 110.964 175.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 22.6 m170 -73.08 -32.24 64.88 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 116.199 -0.455 . . . . 43.1 111.366 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' VAL . 88.0 t -59.45 -38.38 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-O 120.903 0.383 . . . . 73.11 111.924 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.411 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 72.6 m-85 -88.57 32.76 0.77 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.192 0.441 . . . . 65.43 112.192 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.3 t -65.01 -19.83 66.19 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.988 0.423 . . . . 64.01 111.354 175.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.13 144.09 50.37 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.027 0.442 . . . . 50.45 111.641 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.78 -19.51 47.53 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.035 -0.602 . . . . 25.42 113.314 -178.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 28.4 m -75.58 143.62 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.244 0.545 . . . . 64.22 112.365 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 35.7 m -88.77 91.68 8.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.138 -0.483 . . . . 63.13 110.532 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -130.49 133.79 46.56 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.247 0.546 . . . . 73.31 111.808 -178.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.461 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 71.8 m95 -67.46 -17.38 64.67 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.132 -0.485 . . . . 71.13 112.033 -176.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.34 82.55 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.252 -0.499 . . . . 31.13 112.905 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' A' ' 94' ' ' ARG . 25.4 mmt180 -70.91 -32.49 69.44 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.464 -0.433 . . . . 74.22 111.117 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.413 HG13 ' HE3' ' A' ' 92' ' ' TRP . 46.3 mm -62.21 -46.29 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.032 0.444 . . . . 72.24 110.546 174.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -57.41 -48.25 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 116.129 -0.487 . . . . 71.03 110.869 174.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.1 m -56.55 -43.27 79.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.247 -0.433 . . . . 73.43 111.654 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 33.5 tp -59.3 -55.23 37.51 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.211 0.529 . . . . 72.24 111.652 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.1 mt -68.84 -34.08 62.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.071 -0.513 . . . . 75.33 111.449 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -64.91 -45.17 86.99 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.466 -0.333 . . . . 72.52 111.409 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -62.16 -43.06 99.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.77 0.319 . . . . 75.25 110.651 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -46.45 92.03 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.872 -0.68 . . . . 14.22 112.417 175.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 20' ' ' GLN . . . -66.73 -31.95 72.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.076 0.465 . . . . 65.35 111.951 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.19 -48.44 70.65 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.833 0.349 . . . . 63.23 110.571 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.9 t -65.44 -36.48 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.884 0.373 . . . . 74.43 110.573 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.34 -43.75 67.95 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.065 -0.516 . . . . 74.22 111.728 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -54.57 -49.54 70.09 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.149 0.5 . . . . 71.1 110.771 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.476 ' O ' HG12 ' A' ' 112' ' ' ILE . 79.1 t60 -60.87 -40.19 92.03 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.037 -0.529 . . . . 74.41 111.36 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 88.2 mt -62.17 -50.46 71.76 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.715 0.293 . . . . 74.45 111.658 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.473 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.0 tttm -62.89 -33.53 75.49 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.201 0.524 . . . . 75.34 111.212 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.9 m -64.14 -45.38 88.77 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.196 -0.456 . . . . 72.33 111.721 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.512 HG13 ' HG2' ' A' ' 114' ' ' GLN . 47.2 pt -90.33 24.64 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 N-CA-C 112.674 0.62 . . . . 74.41 112.674 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 69.28 12.49 8.4 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.848 0.685 . . . . 72.05 112.848 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.512 ' HG2' HG13 ' A' ' 112' ' ' ILE . 13.6 mm100 -99.61 36.99 1.67 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.071 -0.393 . . . . 70.04 111.633 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.89 -32.81 69.84 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.794 0.331 . . . . 71.2 111.492 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.442 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 52.4 m -53.79 -41.42 67.22 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.93 0.395 . . . . 61.31 111.344 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.457 ' HB2' HD13 ' A' ' 109' ' ' LEU . 53.1 m -56.9 -27.41 60.68 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.844 0.683 . . . . 74.12 112.844 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 63.9 mt -57.77 -33.55 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 112.203 0.446 . . . . 43.44 112.203 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.79 -54.61 6.15 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 112.481 0.549 . . . . 72.4 112.481 -177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.442 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.5 Cg_endo -59.52 -26.38 81.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.518 1.479 . . . . 72.12 111.799 172.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.434 HD12 HD11 ' A' ' 109' ' ' LEU . 6.5 tt -66.19 -46.13 78.37 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.661 -0.496 . . . . 74.52 109.661 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.14 -44.58 87.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.252 -0.431 . . . . 75.11 110.802 174.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -58.82 -39.48 81.3 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.4 -0.364 . . . . 71.33 111.176 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -61.67 -41.83 98.09 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.918 0.39 . . . . 62.1 111.006 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 121' ' ' LEU . 39.7 mm -60.79 -54.1 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-O 121.126 0.489 . . . . 74.53 110.984 177.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.2 m -68.18 -33.64 74.82 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.104 -0.498 . . . . 72.21 112.084 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.8 t70 -61.03 -52.46 64.9 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.283 -0.261 . . . . 64.54 110.788 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 81' ' ' MET . 80.4 t -64.51 -39.3 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.141 0.496 . . . . 72.14 110.975 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.529 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -58.93 -53.49 57.8 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.012 -0.54 . . . . 72.43 111.68 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.408 HG13 ' HB2' ' A' ' 134' ' ' ARG . 89.8 t -76.34 -33.79 24.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 111.955 0.354 . . . . 65.22 111.955 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 17.1 tpp180 -53.14 -33.36 52.11 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.246 0.461 . . . . 73.34 112.246 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.49 -28.75 2.04 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.679 0.992 . . . . 65.41 113.679 -175.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -104.31 9.4 35.93 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 112.757 0.651 . . . . 73.54 112.757 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.408 ' HB2' HG13 ' A' ' 130' ' ' VAL . 20.3 ttt180 -50.83 -53.35 32.91 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 121.091 0.472 . . . . 71.52 112.245 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.35 -47.94 74.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 65.31 111.985 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.45 -36.83 85.05 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.279 -0.263 . . . . 74.12 111.463 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.529 HD11 ' HG ' ' A' ' 129' ' ' LEU . 73.3 mt -57.05 -51.0 71.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.75 0.309 . . . . 70.21 111.507 176.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.5 p -77.96 -40.8 27.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 112.512 0.56 . . . . 73.32 112.512 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -63.0 -57.34 11.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.255 0.465 . . . . 72.13 112.255 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -84.88 -3.9 58.88 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.711 0.291 . . . . 75.25 111.324 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 62.29 89.71 0.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.382 0.611 . . . . 63.03 110.535 -173.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.461 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -58.97 -62.24 6.45 Favored Glycine 0 CA--C 1.521 0.438 0 CA-C-N 115.656 -0.702 . . . . 74.0 114.219 -170.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -71.55 -16.6 62.32 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.168 0.433 . . . . 71.52 112.168 -173.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -80.52 -58.08 3.28 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.989 0.423 . . . . 75.04 110.806 173.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.423 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -60.47 -34.78 86.93 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.876 -0.602 . . . . 65.3 113.1 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -54.81 -49.3 71.34 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.963 0.505 . . . . 74.42 111.508 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.66 -42.6 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.173 -0.467 . . . . 72.31 112.222 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.603 ' HA ' ' HB2' ' A' ' 154' ' ' ASP . 12.5 pt-20 -73.34 -27.76 61.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 111.92 0.341 . . . . 75.44 111.92 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -63.69 -45.75 88.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.182 0.515 . . . . 63.33 110.874 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -81.85 3.43 26.08 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.231 -0.441 . . . . 72.51 111.558 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.625 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 2.0 t60 58.91 37.32 24.72 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.065 0.546 . . . . 43.15 112.057 173.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.6 t -71.29 -69.71 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.953 0.406 . . . . 64.41 111.772 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -96.85 -6.75 35.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.579 0.704 . . . . 73.52 110.4 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.625 ' HB3' ' HA ' ' A' ' 151' ' ' HIS . 4.8 t70 -69.44 169.08 13.14 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.965 -1.016 . . . . 23.13 113.371 -175.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.555 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -134.21 -1.62 2.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 112.906 0.706 . . . . 63.15 112.906 179.355 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 157' ' ' GLY . 12.9 pt-20 -140.31 -45.5 0.42 Allowed 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.086 -0.384 . . . . 74.53 111.888 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' A' ' 156' ' ' GLU . . . 94.2 126.12 4.45 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.501 -0.38 . . . . 63.45 113.883 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -70.28 70.68 0.64 Allowed Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.111 -0.566 . . . . 74.02 111.927 172.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -76.33 -7.97 56.11 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.446 0.536 . . . . 74.04 112.446 -173.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -74.32 121.07 20.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.725 0.298 . . . . 73.34 111.17 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -66.75 -19.52 65.77 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.331 0.493 . . . . 72.24 112.331 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 32.3 t60 65.31 22.44 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.521 0.677 . . . . 74.22 111.242 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -74.48 140.04 44.29 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.964 -0.562 . . . . 73.14 111.11 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.5 p80 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 119.294 -0.384 . . . . 73.31 111.22 178.213 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptp . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 120.926 0.393 . . . . 64.22 111.545 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.02 142.01 51.33 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.799 0.666 . . . . 74.11 112.799 -170.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -84.17 165.09 18.72 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.71 -0.677 . . . . 74.21 110.439 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.29 -42.58 91.62 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.684 0.278 . . . . 74.04 110.427 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.92 -40.61 70.04 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.022 0.439 . . . . 61.44 110.975 177.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -67.65 -39.6 84.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.154 -0.475 . . . . 73.23 110.999 176.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -67.65 -51.25 52.19 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.175 0.435 . . . . 63.34 112.175 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.508 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -52.23 -52.04 54.76 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.755 0.312 . . . . 73.13 111.382 175.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.4 p -63.98 -54.63 31.38 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 111.954 0.353 . . . . 60.31 111.954 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.7 tp -52.89 -45.48 67.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.232 0.456 . . . . 71.4 112.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -62.55 -45.46 92.83 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 120.681 0.277 . . . . 73.3 111.248 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 8' ' ' GLN . 86.0 mt -57.63 -51.34 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.243 0.544 . . . . 74.41 111.093 176.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.463 ' O ' HD13 ' A' ' 17' ' ' LEU . 77.8 mt -61.34 -47.87 91.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 115.759 -0.655 . . . . 65.23 111.486 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 41.8 t -54.35 -50.35 67.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.976 0.417 . . . . 70.41 111.467 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.709 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 35.2 mtp180 -61.33 -48.35 81.7 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.362 -0.381 . . . . 74.2 111.621 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 32.1 t80 -53.4 -48.78 68.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.879 0.371 . . . . 65.02 111.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.51 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.3 mp -59.61 -42.74 93.33 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.662 0.268 . . . . 73.15 111.421 175.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' SER . 37.2 mmt180 -60.39 -43.9 96.21 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.65 0.262 . . . . 70.13 111.429 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 81.1 mt-10 -63.98 -42.63 97.18 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.009 0.433 . . . . 74.42 111.488 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 27.7 mm-40 -71.99 -26.07 62.09 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.07 0.396 . . . . 75.53 112.07 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.427 ' O ' ' HD3' ' A' ' 110' ' ' LYS . . . -84.82 -44.39 13.31 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.33 0.492 . . . . 64.03 112.33 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -87.62 -30.19 20.65 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.017 0.377 . . . . 75.31 112.017 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.57 -1.58 79.13 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.338 -0.458 . . . . 55.42 112.876 -176.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -94.96 -177.13 4.06 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.056 0.455 . . . . 64.44 111.983 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -117.66 154.93 30.79 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.901 0.381 . . . . 72.31 111.559 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -130.32 106.64 8.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.98 0.419 . . . . 73.33 109.891 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.8 t -103.78 14.59 30.63 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.13 0.418 . . . . 74.32 112.13 -177.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.533 ' HZ2' ' HB2' ' A' ' 28' ' ' LYS . 10.2 mtmp? -76.91 164.0 61.97 Favored Pre-proline 0 CA--C 1.546 0.815 0 N-CA-C 111.656 0.243 . . . . 72.54 111.656 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.56 159.99 7.79 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.626 2.218 . . . . 71.1 112.545 174.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.709 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 25.7 tpp -117.14 -83.43 0.64 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.409 0.522 . . . . 61.42 112.409 -173.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.76 -159.0 10.41 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 121.25 -0.5 . . . . 44.31 113.178 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -83.57 -25.88 30.55 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.977 0.362 . . . . 62.22 111.977 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 87.8 p -58.96 -56.85 16.89 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.873 0.368 . . . . 74.02 111.984 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.22 -110.64 3.4 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.469 -0.396 . . . . 71.45 112.987 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.507 ' HB1' ' HE2' ' A' ' 39' ' ' LYS . . . -54.31 -39.13 66.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.794 0.33 . . . . 74.5 111.576 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.6 m -54.69 -52.33 62.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.06 0.457 . . . . 71.35 111.576 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.577 ' HB2' ' HG2' ' A' ' 30' ' ' MET . 59.6 p -67.36 -31.13 71.17 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.842 0.353 . . . . 64.12 111.856 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.443 ' HG3' HH11 ' A' ' 38' ' ' ARG . 1.1 tmm_? -66.49 -53.39 35.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.305 0.574 . . . . 73.32 110.143 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HE2' ' HB1' ' A' ' 35' ' ' ALA . 63.3 mttm -60.95 -39.32 89.04 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.625 -0.716 . . . . 61.03 111.268 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.86 -47.46 82.64 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.409 -0.36 . . . . 74.02 111.706 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.38 -52.62 63.86 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 111.846 0.313 . . . . 72.45 111.846 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.97 -39.77 90.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.771 0.319 . . . . 75.4 111.226 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.572 ' O ' HG22 ' A' ' 47' ' ' VAL . 63.7 m -66.15 -50.06 65.26 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.562 0.22 . . . . 53.14 110.818 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.9 mt -53.99 -45.18 71.36 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.258 0.466 . . . . 64.14 112.258 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HA ' ' CE1' ' A' ' 16' ' ' TYR . 5.0 ptm180 -73.97 -39.03 63.98 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 111.784 0.29 . . . . 72.34 111.784 -176.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -71.97 -35.16 69.46 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.296 -0.253 . . . . 74.43 111.679 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 43' ' ' THR . 17.6 m -87.92 -33.47 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.043 0.449 . . . . 64.44 111.366 177.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -64.3 -42.31 97.85 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-N 116.24 -0.437 . . . . 71.05 113.507 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -54.5 -42.74 71.11 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.912 0.386 . . . . 72.32 111.425 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.6 -43.65 91.64 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.104 -0.569 . . . . 70.3 112.618 176.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 47' ' ' VAL . 97.3 t -59.62 -41.17 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 120.709 0.29 . . . . 65.21 111.318 177.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 78.9 mt-30 -57.96 -41.42 82.85 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.565 -0.289 . . . . 60.5 111.573 178.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 53' ' ' ARG . 16.1 mmm-85 -61.98 -56.1 22.62 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.575 0.583 . . . . 71.24 112.575 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -70.81 -21.84 62.42 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.031 -0.418 . . . . 51.4 111.785 -177.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 24.8 m80 -90.46 -20.47 22.7 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.514 0.561 . . . . 73.52 112.514 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -50.08 -49.57 50.95 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.729 0.64 . . . . 53.25 112.729 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -58.93 -34.01 71.24 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.852 0.358 . . . . 71.44 111.859 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.1 -43.83 23.29 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.889 0.376 . . . . 74.34 111.718 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -64.56 -39.65 94.13 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.483 -0.326 . . . . 71.2 111.373 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -53.0 -41.53 64.72 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.0 0.429 . . . . 74.21 110.816 173.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -62.74 -27.0 69.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 115.904 -0.589 . . . . 73.01 112.958 175.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.574 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 81.5 mtp -81.4 -51.42 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 122.637 -0.331 . . . . 74.51 110.97 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.9 mp -55.0 -37.44 66.6 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.542 0.571 . . . . 71.25 112.542 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -66.41 -25.43 66.76 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 111.978 0.362 . . . . 63.2 111.978 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -96.31 -16.18 21.49 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 122.106 -0.371 . . . . 73.05 110.877 175.422 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.31 -68.26 0.71 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.375 -0.375 . . . . 73.33 111.16 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 54.37 97.71 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.389 0.614 . . . . 63.34 111.938 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.504 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.3 mp -93.1 100.58 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.157 0.503 . . . . 62.51 111.19 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.423 ' HD3' HD22 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -107.27 -6.58 17.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.174 -0.466 . . . . 74.14 112.147 179.198 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.423 HD22 ' HD3' ' A' ' 69' ' ' LYS . 0.8 OUTLIER -155.42 174.85 14.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.825 0.345 . . . . 75.14 111.37 177.646 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.4 -37.37 83.2 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.289 0.477 . . . . 75.3 112.289 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.27 -39.19 66.65 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.788 0.327 . . . . 75.34 111.487 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' ILE . 48.1 m-20 -63.75 -38.28 90.5 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.066 0.46 . . . . 64.32 110.916 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.38 -46.08 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.337 0.589 . . . . 65.3 110.844 175.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 78' ' ' SER . 98.2 mttt -70.0 -23.93 63.22 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.137 -0.483 . . . . 72.11 111.223 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.2 t -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.074 0.464 . . . . 74.53 110.403 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.5 mt -57.2 -37.93 72.93 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.345 -0.388 . . . . 62.03 110.464 174.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 38.5 t -53.25 -37.9 62.51 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.14 -0.482 . . . . 71.13 111.469 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -40.27 97.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.197 0.522 . . . . 74.33 110.54 177.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.5 t -66.94 -39.79 84.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.072 -0.513 . . . . 64.43 110.647 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.543 ' HB3' HD11 ' A' ' 98' ' ' LEU . 21.4 mmt -55.39 -40.51 71.48 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.864 -0.607 . . . . 54.15 111.211 177.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' SER . 73.7 mt -60.74 -33.55 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 116.078 -0.51 . . . . 75.43 111.349 174.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -72.8 -28.86 62.82 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.516 -0.311 . . . . 65.24 111.687 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 92.2 t -58.02 -28.84 34.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 121.064 0.459 . . . . 63.45 111.711 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.509 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 74.0 m-85 -89.85 10.41 23.81 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.853 0.686 . . . . 75.51 112.853 -179.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.1 t -53.57 -33.99 56.75 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.15 0.796 . . . . 75.12 113.15 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.631 ' HB2' ' HD3' ' A' ' 94' ' ' ARG . 6.7 m-20 -55.13 -38.11 67.79 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.712 0.634 . . . . 64.3 112.712 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.28 -50.38 3.43 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 120.919 -0.658 . . . . 62.03 113.339 -177.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.409 ' O ' ' NH2' ' A' ' 94' ' ' ARG . 60.9 t -48.56 134.6 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 112.498 0.555 . . . . 74.41 112.498 -178.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 90' ' ' THR . 8.1 t -67.66 86.1 0.2 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 122.003 0.906 . . . . 54.14 112.441 -177.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -134.08 116.49 15.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.627 -0.715 . . . . 72.32 110.83 175.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.494 ' HE3' HG13 ' A' ' 95' ' ' ILE . 81.8 m95 -63.81 -7.2 7.21 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.525 0.565 . . . . 71.01 112.525 -175.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.1 -31.59 73.42 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.189 -0.529 . . . . 71.1 112.786 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.631 ' HD3' ' HB2' ' A' ' 87' ' ' ASP . 65.8 mtm180 -66.23 -36.2 82.39 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.393 -0.475 . . . . 71.41 111.188 175.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.494 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.4 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.134 0.492 . . . . 74.2 110.501 176.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.19 -49.91 81.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.115 -0.493 . . . . 60.35 111.178 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.8 m -56.01 -41.96 75.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.39 -0.368 . . . . 72.02 111.473 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.543 HD11 ' HB3' ' A' ' 81' ' ' MET . 35.9 tp -61.33 -55.1 35.45 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.27 0.557 . . . . 74.44 111.896 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.401 HG23 HG23 ' A' ' 13' ' ' ILE . 58.0 mt -72.04 -35.26 53.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 116.14 -0.482 . . . . 73.53 111.955 -174.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.2 p -64.7 -44.89 88.81 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.581 0.229 . . . . 63.33 111.044 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -60.26 -41.32 93.01 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.797 0.332 . . . . 74.33 110.991 176.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.71 -43.83 94.33 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.858 -0.686 . . . . 62.44 112.468 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.14 -35.18 79.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.981 0.42 . . . . 74.22 111.439 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.413 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 51.3 t80 -62.44 -42.61 99.59 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.229 -0.441 . . . . 72.34 111.018 177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.442 ' HB ' HD11 ' A' ' 121' ' ' LEU . 47.3 t -71.46 -38.3 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.737 0.303 . . . . 71.35 110.863 175.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.97 73.33 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.345 0.498 . . . . 55.13 112.345 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 19.4 ptpt -61.43 -36.16 79.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.111 0.481 . . . . 72.44 110.925 178.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -68.58 -34.72 76.3 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.376 -0.375 . . . . 74.04 110.89 176.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.498 HD11 HD12 ' A' ' 121' ' ' LEU . 90.0 mt -62.63 -50.36 71.55 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.639 0.257 . . . . 63.22 111.073 177.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 56.6 tttm -61.74 -35.14 77.23 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.905 0.383 . . . . 74.4 111.041 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.2 m -60.48 -41.14 93.62 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.414 -0.357 . . . . 73.54 111.491 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.4 pt -92.94 18.88 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.864 0.364 . . . . 74.11 111.876 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 67.59 16.21 9.85 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.182 0.808 . . . . 73.41 113.182 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -91.95 40.84 1.05 Allowed 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.96 0.409 . . . . 52.1 110.795 173.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.98 -40.8 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.017 0.527 . . . . 71.34 111.812 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 88.3 p -62.94 -33.59 75.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.027 0.38 . . . . 73.22 112.027 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.428 ' HB2' HD13 ' A' ' 109' ' ' LEU . 49.4 m -58.24 -26.11 62.5 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.353 0.501 . . . . 72.41 112.353 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 70.0 mt -54.38 -36.03 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 112.295 0.48 . . . . 62.43 112.295 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -67.08 -58.3 9.45 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 112.331 0.493 . . . . 63.22 112.331 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -57.32 -28.68 81.04 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.634 1.556 . . . . 50.14 112.092 175.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.498 HD12 HD11 ' A' ' 109' ' ' LEU . 5.0 tt -64.41 -50.45 67.55 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 110.008 -0.368 . . . . 72.11 110.008 175.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.28 76.21 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.174 0.511 . . . . 63.44 111.137 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.77 -29.19 67.52 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.325 -0.398 . . . . 71.02 111.594 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.0 m -69.34 -43.52 73.51 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.843 0.354 . . . . 42.15 111.089 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.441 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.6 mm -55.73 -52.92 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.367 0.603 . . . . 65.22 110.43 174.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.4 m -65.43 -35.97 82.52 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.419 -0.81 . . . . 70.34 111.666 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.9 t70 -57.53 -52.54 64.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.733 0.302 . . . . 74.53 110.996 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 132' ' ' THR . 62.1 t -64.36 -42.8 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 120.937 0.399 . . . . 73.1 111.053 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -53.89 -52.84 59.24 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.335 0.588 . . . . 72.44 111.351 178.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.76 -30.74 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.856 -0.611 . . . . 62.24 111.376 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.1 tpt180 -57.47 -49.69 75.47 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.121 0.486 . . . . 63.14 112.179 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.9 t -104.39 -29.56 10.66 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.906 1.076 . . . . 70.52 113.906 -172.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -130.47 22.44 5.13 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.081 1.141 . . . . 74.5 114.081 -171.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' A' ' 137' ' ' LEU . 33.8 ttp180 -54.47 -43.35 71.64 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-O 121.011 0.434 . . . . 71.13 111.983 175.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 33.8 t70 -58.65 -49.58 77.0 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.21 -0.45 . . . . 65.31 111.525 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.46 -35.74 81.82 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.774 0.287 . . . . 72.42 111.774 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.532 HD11 ' HG ' ' A' ' 129' ' ' LEU . 55.9 mt -51.81 -48.45 63.87 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.661 0.267 . . . . 72.32 111.501 174.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.79 -31.85 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 112.446 0.536 . . . . 63.14 112.446 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 45.1 mmtm -65.47 -64.33 0.89 Allowed 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.965 -0.46 . . . . 71.33 112.186 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -85.6 4.02 38.11 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.419 -0.355 . . . . 75.25 111.247 -176.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 51.49 72.17 0.39 Allowed 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.231 0.539 . . . . 72.23 110.084 -172.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.33 -50.29 6.63 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.218 -0.901 . . . . 70.01 114.793 -171.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.457 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.5 m95 -72.95 -26.26 61.32 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.32 0.489 . . . . 74.53 112.32 -175.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -76.42 -53.93 7.45 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.279 0.562 . . . . 72.24 110.587 173.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.446 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -58.39 -33.64 71.82 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.716 -0.675 . . . . 71.41 112.673 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.56 -45.71 81.13 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.301 0.572 . . . . 74.43 111.58 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.499 HG13 ' HB ' ' A' ' 152' ' ' VAL . 47.2 t -70.26 -42.34 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.941 -0.572 . . . . 65.12 112.026 -177.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.446 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.8 pt-20 -73.34 -27.89 61.76 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.783 0.325 . . . . 74.41 111.36 177.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.4 ' CZ ' ' HB3' ' A' ' 162' ' ' HIS . 82.0 t80 -61.89 -48.96 78.16 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.575 0.35 . . . . 71.45 111.675 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -83.21 -10.99 58.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 111.961 0.356 . . . . 64.32 111.961 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.439 ' CG ' ' HA3' ' A' ' 158' ' ' GLY . 22.2 t-160 65.75 74.83 0.36 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.197 0.522 . . . . 62.51 111.405 -177.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 147' ' ' VAL . 59.9 t -111.17 -68.77 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 73.31 110.158 174.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.463 ' HG3' HG12 ' A' ' 152' ' ' VAL . 65.7 mt-10 -137.84 84.76 2.06 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.096 0.474 . . . . 75.5 111.228 174.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -102.62 -164.68 1.11 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.117 -0.492 . . . . 73.51 110.516 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.54 HD22 ' HG3' ' A' ' 156' ' ' GLU . 0.0 OUTLIER -124.83 11.96 8.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.28 0.474 . . . . 74.11 112.28 -178.033 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.54 ' HG3' HD22 ' A' ' 155' ' ' LEU . 43.9 mt-10 -115.99 -71.58 0.73 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.341 0.591 . . . . 74.12 111.155 177.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 170.83 26.36 0.02 OUTLIER Glycine 0 CA--C 1.527 0.781 0 CA-C-N 115.615 -0.72 . . . . 73.52 112.51 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLY . . . . . 0.439 ' HA3' ' CG ' ' A' ' 151' ' ' HIS . . . 75.94 148.36 2.24 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 113.951 0.341 . . . . 73.13 113.951 -176.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -72.37 141.4 48.75 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.931 0.396 . . . . 72.51 110.727 175.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -76.23 -37.67 57.4 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.422 -0.354 . . . . 74.23 111.687 -175.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -138.54 135.7 35.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.786 0.326 . . . . 74.42 111.026 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 149' ' ' PHE . 69.4 m-70 -84.07 71.45 10.55 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.745 0.307 . . . . 72.34 111.099 -175.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 61.2 m80 58.0 12.44 1.8 Allowed 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.844 0.354 . . . . 53.2 111.884 -173.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.361 -0.828 . . . . 72.3 110.595 -178.995 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.724 0.297 . . . . 72.31 111.5 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.91 148.43 27.68 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.172 0.51 . . . . 75.52 112.087 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -89.79 156.75 18.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 116.042 -0.526 . . . . 72.45 110.668 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -55.52 -41.58 73.31 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.891 0.377 . . . . 44.21 111.305 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.6 tp -55.93 -46.79 78.37 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.045 -0.525 . . . . 40.43 110.9 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -62.72 -43.26 99.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.155 -0.475 . . . . 73.0 110.879 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -58.47 -44.63 89.38 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.341 0.497 . . . . 52.11 112.341 177.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.441 ' O ' HG13 ' A' ' 12' ' ' ILE . 47.7 tt0 -73.15 -45.03 59.03 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.707 0.262 . . . . 61.34 111.707 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.0 p -60.91 -53.1 61.45 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.695 0.283 . . . . 62.24 111.148 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.9 tp -54.53 -40.83 69.03 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.379 -0.373 . . . . 54.23 111.559 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.538 ' HG2' ' HA2' ' A' ' 31' ' ' GLY . 9.8 tp10 -57.39 -51.64 68.6 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.132 0.491 . . . . 65.01 111.317 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 8' ' ' GLN . 57.2 mt -64.21 -49.75 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.043 -0.526 . . . . 74.11 111.37 -178.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.417 ' O ' HD13 ' A' ' 17' ' ' LEU . 86.0 mt -62.32 -47.29 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 116.224 -0.444 . . . . 72.03 111.662 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 39.3 t -54.66 -54.6 39.57 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.512 -0.313 . . . . 73.43 111.642 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.465 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 71.0 mtp180 -60.27 -45.84 91.89 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.666 -0.243 . . . . 73.25 111.499 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -56.12 -48.54 76.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.884 0.373 . . . . 71.1 111.555 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.1 mp -59.39 -41.89 90.44 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.741 -0.209 . . . . 73.44 111.452 176.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 22.1 mmm180 -63.79 -55.36 23.64 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 111.688 0.255 . . . . 73.41 111.688 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 6.9 pt-20 -61.62 -40.6 95.43 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.015 0.376 . . . . 74.2 112.015 -177.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.7 mm-40 -70.66 -22.74 62.46 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.161 -0.337 . . . . 74.52 111.439 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -80.04 -43.06 22.55 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 111.88 0.326 . . . . 75.32 111.88 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.5 p -87.4 -16.83 33.78 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.924 0.392 . . . . 70.31 111.662 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.91 7.79 88.17 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 121.105 -0.569 . . . . 74.11 112.527 -176.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.95 141.4 38.43 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.482 . . . . 64.54 111.581 -177.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.9 mtpt -80.83 156.13 26.27 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.016 -0.538 . . . . 75.33 111.8 -177.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -101.59 -172.48 2.16 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.673 0.273 . . . . 71.13 110.743 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.2 t -143.27 48.55 1.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.741 . . . . 62.52 112.294 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -87.99 160.56 46.16 Favored Pre-proline 0 N--CA 1.477 0.918 0 O-C-N 122.035 -0.416 . . . . 72.13 112.026 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -64.41 118.17 5.16 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.338 2.025 . . . . 75.11 111.308 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.465 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 13.6 tpt -83.23 106.64 15.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.442 1.275 . . . . 74.41 114.442 -164.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.538 ' HA2' ' HG2' ' A' ' 11' ' ' GLU . . . 67.12 179.43 12.04 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 115.853 1.101 . . . . 61.44 115.853 167.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.02 -40.63 16.65 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.225 -0.487 . . . . 62.02 110.89 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.9 t -72.87 -28.21 62.37 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 116.212 -0.449 . . . . 70.03 111.752 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.96 -97.42 1.97 Allowed Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.064 -0.589 . . . . 52.12 113.164 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.38 -49.67 75.44 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.183 0.438 . . . . 73.44 112.183 -176.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.4 m -60.47 -41.06 93.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.092 0.472 . . . . 64.12 111.107 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.3 m -62.99 -42.39 99.83 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.273 -0.422 . . . . 74.34 111.15 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -63.55 -55.95 19.79 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.888 0.375 . . . . 65.33 111.572 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 147' ' ' VAL . 3.2 ptmm? -63.18 -29.36 70.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.34 -0.391 . . . . 73.21 111.404 -174.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.16 82.36 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.929 0.395 . . . . 74.01 111.06 173.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.2 tp -59.22 -54.39 47.43 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.306 -0.407 . . . . 71.32 111.92 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.37 -24.79 64.83 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.025 0.379 . . . . 75.52 112.025 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.495 HG23 HG21 ' A' ' 152' ' ' VAL . 28.3 m -66.49 -42.52 87.28 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 122.106 -0.371 . . . . 75.45 110.3 169.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.4 mt -56.41 -31.89 64.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.691 0.282 . . . . 53.41 111.513 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -68.76 -54.45 15.94 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.289 0.566 . . . . 61.13 110.68 174.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 24.3 ttt180 -56.46 -44.84 80.91 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.287 -0.869 . . . . 63.53 112.416 -177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 43' ' ' THR . 15.6 m -93.72 -33.08 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.179 0.437 . . . . 74.01 112.179 -178.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.63 -49.52 59.52 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.229 -0.51 . . . . 65.44 113.602 -174.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.541 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 14.8 t70 -61.57 -35.99 79.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 117.223 0.512 . . . . 64.31 110.751 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.9 -50.15 70.83 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 121.075 -0.583 . . . . 75.03 112.089 174.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 86.8 t -58.23 -38.46 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.831 0.348 . . . . 74.12 111.192 176.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.4 mt-30 -57.01 -50.56 72.34 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.616 -0.265 . . . . 73.31 111.2 175.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 15.2 mmp_? -55.26 -50.18 70.14 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.904 0.705 . . . . 73.22 112.904 -175.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -78.39 -23.1 46.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 112.59 0.589 . . . . 71.42 112.59 -177.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -91.68 -16.96 26.2 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.629 0.603 . . . . 72.1 112.629 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -48.61 -57.95 5.44 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.508 0.929 . . . . 74.03 113.508 -167.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -62.49 -31.36 72.09 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.08 0.466 . . . . 63.45 111.523 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.41 -30.5 67.4 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.988 0.423 . . . . 61.34 111.216 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -76.98 -43.04 36.46 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.422 -0.354 . . . . 72.42 111.224 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -52.05 -40.0 60.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.825 0.345 . . . . 64.12 111.49 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.94 -33.36 56.8 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 121.4 -0.429 . . . . 72.55 113.603 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 67.0 mtm -91.0 -37.29 13.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.494 0.664 . . . . 71.25 110.44 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 63' ' ' LEU . 13.4 tp -63.44 -38.08 89.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.483 -0.78 . . . . 72.53 111.786 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.72 -39.8 74.55 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.232 -0.44 . . . . 73.05 112.183 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -2.62 58.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.833 0.349 . . . . 74.13 111.636 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.09 -75.7 0.51 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.94 0.4 . . . . 75.01 110.99 174.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 43.34 83.37 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.48 -0.782 . . . . 62.34 111.063 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.602 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.6 mp -60.31 113.61 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.716 -0.675 . . . . 72.51 112.031 -172.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -104.32 -8.98 18.86 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.986 -0.552 . . . . 61.34 112.155 -179.497 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -166.35 179.75 5.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.911 0.386 . . . . 45.31 111.759 173.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -53.63 -38.8 64.41 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.563 0.579 . . . . 71.1 112.563 -178.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.16 -39.21 63.41 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.825 0.345 . . . . 61.25 111.79 -178.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.546 ' HB2' HG23 ' A' ' 68' ' ' ILE . 21.7 m-20 -69.26 -34.47 74.82 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.947 0.404 . . . . 73.14 110.812 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.55 -39.58 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.271 0.557 . . . . 75.31 110.324 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -62.95 -38.83 92.66 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.174 0.511 . . . . 74.44 110.451 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 45.7 t -62.86 -34.14 76.75 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.095 -0.502 . . . . 62.52 111.33 174.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.498 HD21 HD11 ' A' ' 68' ' ' ILE . 90.4 mt -62.48 -40.01 95.32 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.734 0.302 . . . . 71.24 111.024 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.5 t -52.53 -38.54 59.89 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.176 0.513 . . . . 71.23 111.194 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -58.09 -41.03 82.6 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.051 -0.522 . . . . 73.31 110.894 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.06 -41.29 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 120.951 0.405 . . . . 63.2 110.725 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.2 mmt -54.7 -40.68 69.41 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.992 -0.549 . . . . 73.0 111.241 178.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.31 -32.67 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-O 121.085 0.469 . . . . 60.31 111.313 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -74.31 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 111.829 0.307 . . . . 61.52 111.829 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 67.9 t -57.66 -43.01 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.091 0.472 . . . . 71.34 111.342 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.2 m-85 -82.5 44.05 0.86 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.033 0.444 . . . . 73.52 111.963 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.7 t -71.51 -0.85 11.47 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.446 0.536 . . . . 62.12 112.446 -178.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -147.01 -174.62 4.54 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.977 0.418 . . . . 64.02 111.664 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.19 56.67 0.61 Allowed Glycine 0 CA--C 1.527 0.842 0 C-N-CA 120.936 -0.65 . . . . 62.14 113.799 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.53 HG22 ' H ' ' A' ' 91' ' ' ASN . 15.0 p -73.29 147.76 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 116.931 0.365 . . . . 70.23 111.278 176.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 75.1 p -69.76 -6.61 33.24 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.425 0.528 . . . . 75.21 112.425 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.53 ' H ' HG22 ' A' ' 89' ' ' VAL . 79.9 m-20 -77.93 150.85 33.96 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.083 0.468 . . . . 72.05 111.592 177.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.488 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.6 m95 -93.69 -2.68 53.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.423 0.527 . . . . 72.54 112.423 -177.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.36 -35.78 51.46 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.239 -0.505 . . . . 62.04 113.05 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -56.65 -43.05 79.94 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.942 0.401 . . . . 73.12 111.592 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' HE3' ' A' ' 92' ' ' TRP . 43.9 mm -66.68 -43.29 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-O 121.078 0.465 . . . . 72.21 110.322 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.9 t -57.38 -42.32 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.026 -0.534 . . . . 72.04 110.595 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.3 m -57.4 -46.76 83.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 72.42 111.417 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.506 ' HG ' HG23 ' A' ' 125' ' ' ILE . 31.2 tp -58.35 -54.52 46.07 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.142 0.496 . . . . 70.32 111.381 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.2 mt -65.53 -37.96 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.055 -0.52 . . . . 74.03 111.959 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.4 m -63.19 -45.82 89.94 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 116.565 -0.289 . . . . 71.3 111.355 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -65.49 -39.5 91.97 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 120.768 0.318 . . . . 75.54 110.863 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.87 -47.93 85.58 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.962 -0.637 . . . . 54.4 112.377 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.498 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.35 -32.29 73.6 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.854 0.359 . . . . 75.44 111.341 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.456 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 39.0 t80 -63.51 -42.84 98.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.081 0.467 . . . . 51.5 111.12 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.491 HG11 HD11 ' A' ' 77' ' ' LEU . 45.5 t -72.2 -40.47 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.932 0.396 . . . . 72.3 110.674 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.442 ' HB1' HG23 ' A' ' 118' ' ' ILE . . . -58.3 -45.3 88.26 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.139 -0.482 . . . . 63.02 112.291 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 17.1 ptmt -64.12 -32.94 74.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.783 0.325 . . . . 71.3 111.031 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.31 -34.24 75.77 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.748 0.309 . . . . 55.22 110.553 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.602 HD21 ' HB ' ' A' ' 68' ' ' ILE . 92.9 mt -61.82 -49.23 77.12 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.747 0.308 . . . . 72.45 111.148 176.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.425 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 8.5 tmtm? -54.29 -44.3 71.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 110.066 -0.346 . . . . 74.33 110.066 176.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.7 m -52.67 -50.53 63.08 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.223 -0.444 . . . . 53.13 111.863 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 38.6 pt -87.29 15.78 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 112.562 0.578 . . . . 74.43 112.562 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 68.51 18.29 8.95 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.938 0.718 . . . . 73.24 112.938 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -91.66 43.27 1.13 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.011 0.434 . . . . 71.01 111.265 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.91 -17.54 61.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.078 0.399 . . . . 64.41 112.078 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.446 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 72.2 p -71.48 -48.3 50.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.91 0.386 . . . . 73.51 111.012 173.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.487 ' HB2' HD13 ' A' ' 109' ' ' LEU . 24.5 m -56.7 -28.23 60.47 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.061 -0.518 . . . . 73.53 111.991 -177.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.442 HG23 ' HB1' ' A' ' 106' ' ' ALA . 70.9 mt -55.45 -40.95 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 112.639 0.607 . . . . 71.15 112.639 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.06 -53.95 22.75 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 112.203 0.445 . . . . 63.22 112.203 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.446 ' HD2' ' O ' ' A' ' 116' ' ' SER . 23.5 Cg_endo -62.02 -25.04 77.31 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 121.579 1.519 . . . . 64.24 112.438 173.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 109' ' ' LEU . 3.9 tt -61.25 -46.48 90.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.698 -0.482 . . . . 73.54 109.698 174.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.05 -33.75 65.28 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.052 0.453 . . . . 64.53 111.439 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -68.18 -39.44 82.51 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.198 -0.455 . . . . 74.42 111.914 177.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 98.3 p -63.35 -47.48 81.95 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.815 0.28 . . . . 63.31 111.099 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.506 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.9 mm -52.86 -53.23 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.384 0.611 . . . . 74.21 111.028 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.8 m -66.67 -35.83 81.09 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.671 -0.695 . . . . 65.51 111.612 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.617 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 33.3 t70 -61.0 -53.0 62.63 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.755 -0.202 . . . . 72.55 110.912 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.75 -41.42 92.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 120.95 0.405 . . . . 55.42 111.097 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.6 ' HG ' HD11 ' A' ' 137' ' ' LEU . 24.8 tp -52.9 -52.52 57.28 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.284 0.564 . . . . 61.01 111.036 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 89.2 t -74.16 -35.22 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.97 -0.559 . . . . 55.14 111.576 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.617 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.1 ttt180 -54.83 -32.8 60.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.114 0.566 . . . . 73.13 112.106 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.75 HG23 ' HD2' ' A' ' 133' ' ' LYS . 1.6 t -127.1 -18.97 4.46 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 52.52 113.765 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.75 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.3 mptp? -123.68 20.95 9.34 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.17 0.804 . . . . 74.43 113.17 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 48.3 ttp180 -45.66 -64.11 0.81 Allowed 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.228 0.537 . . . . 72.11 112.424 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.12 -40.24 93.04 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.742 -0.663 . . . . 73.5 111.826 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -60.04 -42.07 93.62 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 122.239 -0.288 . . . . 71.11 111.61 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.6 HD11 ' HG ' ' A' ' 129' ' ' LEU . 83.3 mt -53.18 -52.53 58.54 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.942 0.401 . . . . 75.21 111.523 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.13 -38.33 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 112.326 0.491 . . . . 53.41 112.326 -176.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -65.11 -40.99 95.3 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.22 0.452 . . . . 70.12 112.22 -177.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -89.76 0.94 56.69 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.352 -0.217 . . . . 74.04 111.576 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 55.16 74.06 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.614 0.721 . . . . 65.42 110.07 -173.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.435 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -53.47 -68.58 1.56 Allowed Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.97 -1.014 . . . . 44.23 115.173 -168.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -67.16 -12.42 59.97 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.156 0.428 . . . . 74.1 112.156 -173.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -84.42 -58.37 2.77 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.993 0.425 . . . . 71.35 110.566 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.545 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -62.58 -30.27 76.12 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.029 -0.532 . . . . 72.42 113.053 178.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -53.96 -47.7 71.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.338 0.589 . . . . 63.01 111.474 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 39' ' ' LYS . 24.3 t -73.79 -39.46 52.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.867 -0.606 . . . . 71.44 112.293 -174.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.59 ' HB2' ' HA3' ' A' ' 157' ' ' GLY . 9.2 pt-20 -66.91 -38.65 86.62 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.825 0.345 . . . . 70.33 110.677 176.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.434 ' N ' ' HG3' ' A' ' 148' ' ' GLU . 84.3 t80 -53.69 -48.02 69.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.286 -0.416 . . . . 64.11 111.716 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -82.41 -5.47 58.67 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.791 0.329 . . . . 72.4 111.634 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.412 ' HE1' ' HA2' ' A' ' 158' ' ' GLY . 29.6 m-70 59.31 26.41 15.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.375 0.67 . . . . 73.41 112.373 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.495 HG21 HG23 ' A' ' 43' ' ' THR . 96.7 t -57.6 -44.27 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.023 0.44 . . . . 73.02 112.053 -176.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.18 -45.29 1.02 Allowed 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.304 0.573 . . . . 75.31 110.563 176.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.96 67.03 6.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.406 0.622 . . . . 54.21 111.546 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.447 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -61.36 -26.06 67.58 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.048 -0.523 . . . . 55.14 112.015 -179.479 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.436 ' N ' HD22 ' A' ' 155' ' ' LEU . 10.4 pt-20 -66.89 -14.88 63.22 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.871 0.323 . . . . 73.11 111.871 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' GLY . . . . . 0.59 ' HA3' ' HB2' ' A' ' 148' ' ' GLU . . . -91.88 97.85 2.35 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 121.299 -0.477 . . . . 70.04 112.276 175.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLY . . . . . 0.412 ' HA2' ' HE1' ' A' ' 151' ' ' HIS . . . -128.22 49.38 0.93 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.07 -0.586 . . . . 62.01 113.096 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -74.24 88.69 2.01 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 122.322 -0.516 . . . . 62.25 111.988 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -78.16 156.92 29.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.947 0.403 . . . . 72.04 111.553 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -136.97 111.11 8.34 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.772 0.32 . . . . 73.24 111.835 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -159.63 112.92 2.22 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.93 0.395 . . . . 74.51 111.161 173.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -93.8 160.97 14.51 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.255 -0.43 . . . . 72.21 111.311 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.8 p80 . . . . . 0 C--O 1.252 1.211 0 CA-C-N 116.317 -0.401 . . . . 72.53 111.676 -179.345 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.9 mmm . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.962 0.41 . . . . 63.11 110.464 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.11 -165.85 1.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.134 0.492 . . . . 73.53 111.741 -171.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -101.87 156.24 17.64 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.174 -0.466 . . . . 74.34 110.985 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -54.28 -43.88 71.43 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.14 0.495 . . . . 65.34 111.245 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.2 tp -59.75 -34.91 73.58 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.839 -0.618 . . . . 73.02 111.437 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -66.65 -46.03 77.06 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.37 -0.377 . . . . 65.34 110.331 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -60.75 -43.64 97.7 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.972 0.415 . . . . 75.15 111.22 177.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.473 ' OE1' ' HB2' ' A' ' 32' ' ' ARG . 7.1 tp60 -56.17 -53.71 53.91 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.343 0.592 . . . . 71.34 111.131 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.3 m -64.98 -43.78 91.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.659 -0.7 . . . . 55.44 111.495 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.78 -44.69 93.78 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.377 -0.374 . . . . 75.44 111.555 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' A' ' 31' ' ' GLY . 5.6 tp10 -57.35 -51.35 69.77 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.263 0.554 . . . . 74.03 111.193 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.449 HG23 ' HB2' ' A' ' 41' ' ' LEU . 68.1 mt -59.85 -54.06 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.93 -0.577 . . . . 74.24 111.6 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.475 HD13 HG22 ' A' ' 125' ' ' ILE . 81.1 mt -61.99 -42.26 94.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 116.132 -0.485 . . . . 72.42 111.822 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.8 t -55.07 -53.88 50.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.89 0.376 . . . . 71.13 111.836 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.69 -39.15 93.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.552 -0.295 . . . . 62.51 111.511 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 57.0 t80 -59.85 -49.06 79.19 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.09 0.471 . . . . 71.11 111.489 178.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.0 mp -62.71 -38.13 89.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.765 0.317 . . . . 73.32 111.211 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -65.73 -43.31 89.41 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.011 0.375 . . . . 62.45 112.011 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 3.2 pt-20 -69.49 -39.65 77.51 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.109 -0.369 . . . . 74.3 111.571 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.506 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.6 mm-40 -71.43 -28.08 63.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.788 0.328 . . . . 74.02 111.397 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.57 -41.87 44.83 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 111.872 0.323 . . . . 62.2 111.872 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.3 p -88.27 -29.97 20.0 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.032 0.444 . . . . 63.11 112.184 -178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.87 12.21 59.42 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.427 -0.416 . . . . 42.31 112.398 -174.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -143.08 127.17 17.44 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.736 0.303 . . . . 44.15 111.588 -178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.95 162.26 13.09 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.859 0.362 . . . . 74.52 111.133 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -112.71 -175.33 2.65 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.354 0.597 . . . . 71.32 111.916 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.1 t -141.71 23.98 2.07 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.773 -0.649 . . . . 72.12 110.135 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' A' ' 28' ' ' LYS . 42.1 mtmt -64.65 154.24 85.4 Favored Pre-proline 0 N--CA 1.467 0.422 0 CA-C-N 115.698 -0.683 . . . . 64.43 111.253 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -49.44 126.94 16.96 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.615 2.21 . . . . 73.11 112.257 177.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.6 tpt -78.07 148.7 34.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.656 -0.247 . . . . 64.5 111.422 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.471 ' H ' ' HG2' ' A' ' 11' ' ' GLU . . . -50.01 -76.51 0.16 Allowed Glycine 0 CA--C 1.531 1.069 0 N-CA-C 115.243 0.857 . . . . 42.31 115.243 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.473 ' HB2' ' OE1' ' A' ' 8' ' ' GLN . 4.8 mmp_? -86.77 -82.08 0.21 Allowed 'General case' 0 CA--C 1.543 0.686 0 O-C-N 122.327 -0.514 . . . . 74.25 112.009 -176.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.9 m -81.22 177.64 8.88 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 120.893 0.378 . . . . 73.0 111.887 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -109.84 -76.14 0.87 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.262 -0.494 . . . . 34.44 112.797 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.33 68.44 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.152 0.427 . . . . 75.22 112.152 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.575 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . 59.8 m -59.53 -52.04 67.26 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.276 0.472 . . . . 75.35 112.276 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.9 p -61.05 -45.48 94.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.296 -0.411 . . . . 75.05 111.461 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -46.27 81.7 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 111.864 0.32 . . . . 75.02 111.864 179.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.669 ' HG3' HG21 ' A' ' 147' ' ' VAL . 24.2 pttm -67.17 -28.8 68.41 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.088 -0.382 . . . . 73.15 111.62 -178.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.32 -51.92 64.01 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.925 0.393 . . . . 74.42 110.498 173.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB2' HG23 ' A' ' 12' ' ' ILE . 65.5 tp -59.01 -44.85 91.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.31 0.576 . . . . 72.51 111.208 175.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.37 -41.2 88.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.781 -0.645 . . . . 74.25 111.161 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.1 m -72.1 -38.35 69.35 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.315 -0.402 . . . . 54.32 111.02 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.0 mt -53.64 -47.05 70.68 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 111.944 0.35 . . . . 72.21 111.944 177.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -74.14 -29.78 61.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.774 0.321 . . . . 74.31 111.42 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -63.45 -45.1 92.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.796 0.331 . . . . 72.31 111.396 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.84 -30.4 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.028 0.442 . . . . 71.44 111.468 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.39 -44.39 97.65 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.921 -0.582 . . . . 61.04 112.953 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 23.1 t70 -50.84 -57.37 8.62 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.837 0.351 . . . . 64.21 110.955 176.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.07 -45.13 92.75 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.399 -0.429 . . . . 45.44 113.548 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 85.1 t -62.92 -42.62 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.883 0.373 . . . . 64.55 111.508 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 27.8 mt-30 -66.74 -27.5 67.66 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.024 0.379 . . . . 75.54 112.024 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 21.6 mmt180 -64.07 -42.84 96.84 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.389 . . . . 73.51 111.193 175.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -84.05 -49.82 8.55 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.117 0.484 . . . . 72.33 112.272 -176.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -75.06 -20.99 59.29 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.317 0.858 . . . . 72.04 113.317 -172.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' A' ' 52' ' ' GLN . 42.7 tt0 -50.49 -52.51 37.66 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.102 0.408 . . . . 64.13 112.102 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -55.69 -36.96 67.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.962 0.41 . . . . 61.02 111.824 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.32 62.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.916 0.389 . . . . 74.21 111.565 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -66.17 -37.94 86.84 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.545 -0.298 . . . . 65.33 111.507 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.625 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 79.4 mm-40 -48.86 -49.49 39.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 74.52 111.175 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -32.28 52.93 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.242 -0.436 . . . . 53.11 113.689 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.408 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 46.2 mtm -89.37 -30.22 18.54 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.241 0.543 . . . . 73.22 110.356 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.8 tp -63.04 -30.78 71.87 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 63.23 111.021 -178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.625 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 61.6 mtp180 -68.24 -16.55 64.01 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.934 -0.576 . . . . 72.14 112.222 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.37 5.85 23.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.001 0.429 . . . . 72.04 111.332 176.104 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 98.5 mt -103.85 -73.72 0.66 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.292 -0.413 . . . . 75.23 111.226 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 38.26 87.06 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.125 0.787 . . . . 74.2 113.125 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -65.92 113.5 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.401 -0.818 . . . . 75.45 112.065 -176.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.91 -6.03 27.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.375 -0.375 . . . . 53.43 111.641 177.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -173.36 174.62 3.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 120.932 0.396 . . . . 72.35 111.644 172.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -50.84 -30.48 14.52 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.493 0.553 . . . . 73.42 112.493 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -52.99 -41.75 64.9 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.122 0.487 . . . . 71.34 111.444 176.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 17.4 m-20 -73.18 -28.42 62.2 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.301 -0.409 . . . . 62.3 111.122 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -62.19 -40.92 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.299 0.571 . . . . 74.23 110.386 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.99 -30.72 70.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.042 -0.526 . . . . 74.34 110.851 174.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.5 t -66.06 -37.63 86.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.181 0.515 . . . . 51.42 110.529 171.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.4 mt -62.13 -38.11 87.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.225 -0.443 . . . . 70.53 110.873 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.8 t -52.74 -41.02 63.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.983 0.42 . . . . 72.31 111.198 177.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -55.5 -47.24 76.5 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.212 -0.449 . . . . 74.31 110.752 175.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.61 -41.79 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.969 0.414 . . . . 54.41 111.007 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.488 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.8 mmt -56.18 -41.99 76.39 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.046 -0.525 . . . . 74.55 111.206 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.67 -37.3 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.16 -0.473 . . . . 74.33 110.957 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -65.11 -28.83 69.71 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 122.339 -0.225 . . . . 70.43 111.388 177.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.99 -39.62 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 51.32 110.994 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.542 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 26.9 m-85 -89.0 26.92 1.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.302 -0.408 . . . . 71.44 112.034 178.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.8 t -73.86 -12.19 60.6 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.944 0.402 . . . . 75.31 111.104 175.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.06 137.94 31.95 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.242 -0.435 . . . . 72.14 110.507 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -119.64 37.34 3.16 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 120.525 -0.845 . . . . 73.14 114.808 -172.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.0 m -121.09 169.98 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 117.86 0.83 . . . . 54.15 111.067 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.9 p -76.09 91.71 3.14 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.325 0.491 . . . . 74.34 112.325 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -147.57 103.64 3.55 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.494 0.664 . . . . 73.32 111.682 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -63.17 -11.2 18.92 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.239 -0.437 . . . . 65.35 112.109 -178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.94 -26.83 55.88 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 121.416 -0.421 . . . . 53.11 112.998 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -62.67 -42.17 99.48 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.054 0.454 . . . . 53.03 110.369 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -63.27 -45.26 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.896 -0.593 . . . . 72.44 110.561 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.44 -48.41 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.982 -0.553 . . . . 72.34 110.948 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.4 m -57.26 -45.66 83.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.22 -0.446 . . . . 72.33 111.563 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.542 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 23.8 tp -57.77 -54.94 41.2 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.343 0.592 . . . . 73.04 111.797 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.441 HG22 ' CD2' ' A' ' 16' ' ' TYR . 51.7 mt -71.62 -37.53 63.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.864 -0.607 . . . . 71.41 112.08 -174.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 92.3 p -66.94 -44.08 81.53 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.631 0.253 . . . . 42.35 111.263 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.48 -40.19 93.64 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.799 0.333 . . . . 53.32 110.717 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.14 -47.61 86.22 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.895 -0.669 . . . . 75.05 112.365 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.01 79.6 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.098 0.475 . . . . 62.42 111.5 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.426 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 80.2 t80 -62.01 -45.73 92.29 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.059 -0.519 . . . . 74.52 111.325 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 56.2 t -69.93 -38.39 75.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 120.836 0.351 . . . . 75.54 110.787 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.76 69.13 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.292 0.479 . . . . 74.03 112.292 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 18.1 ptpt -62.83 -36.55 83.57 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.851 0.357 . . . . 73.34 111.227 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.423 ' O ' HG12 ' A' ' 112' ' ' ILE . 71.7 t60 -65.3 -33.7 76.59 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.909 0.385 . . . . 65.12 110.33 176.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.504 HD21 ' HB ' ' A' ' 68' ' ' ILE . 89.0 mt -67.41 -50.56 58.96 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.203 -0.453 . . . . 74.44 111.093 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -57.04 -40.57 77.02 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.166 0.508 . . . . 63.43 110.477 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.8 m -55.97 -48.91 74.95 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.604 -0.725 . . . . 43.22 111.699 175.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 108' ' ' HIS . 37.1 pt -88.7 22.2 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 N-CA-C 112.142 0.423 . . . . 52.23 112.142 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 68.32 12.11 8.61 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.918 0.71 . . . . 74.4 112.918 174.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -94.76 38.08 1.12 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.289 0.477 . . . . 71.31 112.289 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.87 -32.27 63.53 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.924 -0.485 . . . . 75.03 110.87 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.7 m -56.9 -29.1 62.71 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.216 -0.447 . . . . 74.33 111.873 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.474 ' HB2' HD13 ' A' ' 109' ' ' LEU . 44.5 m -76.99 -27.07 54.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.485 -0.325 . . . . 55.5 111.706 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.9 mt -59.54 -38.47 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.95 0.352 . . . . 73.02 111.95 -179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.7 -57.17 28.4 Favored Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 112.058 0.392 . . . . 72.13 112.058 -176.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.74 -26.9 60.22 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 121.669 1.579 . . . . 73.02 112.367 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.81 -48.42 76.92 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.706 0.288 . . . . 75.22 110.235 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.39 -40.69 71.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.223 0.535 . . . . 70.42 111.001 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.69 -35.84 79.57 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.928 -0.578 . . . . 64.41 111.357 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.6 m -63.68 -45.41 90.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.731 0.301 . . . . 62.0 111.314 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.477 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.5 mm -54.84 -50.64 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.352 0.596 . . . . 73.12 110.636 175.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 26.7 m -67.93 -33.63 75.06 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.545 -0.752 . . . . 61.15 111.52 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.435 ' O ' ' HD3' ' A' ' 131' ' ' ARG . 15.2 t70 -64.02 -52.73 58.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.375 -0.375 . . . . 51.3 110.681 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 98.5 t -62.49 -41.73 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.149 0.5 . . . . 70.23 110.821 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' ' 137' ' ' LEU . 48.9 tp -54.32 -52.8 60.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.848 -0.614 . . . . 75.23 111.235 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 83.2 t -76.02 -27.33 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.157 -0.474 . . . . 73.32 111.9 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 127' ' ' ASP . 0.7 OUTLIER -54.85 -38.12 67.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.22 0.452 . . . . 75.05 112.22 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.417 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.5 OUTLIER -130.46 -37.41 1.4 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.154 0.798 . . . . 64.34 113.154 -175.776 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.417 ' HD2' HG23 ' A' ' 132' ' ' THR . 0.2 OUTLIER -92.5 6.16 48.15 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.971 0.73 . . . . 40.53 112.971 -177.561 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 12.7 ttp180 -49.83 -64.44 0.81 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.719 0.637 . . . . 74.31 112.719 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.09 -34.06 69.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 75.42 111.924 -178.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' TRP . . . . . 0.411 ' HD1' ' HA ' ' A' ' 133' ' ' LYS . 50.3 m95 -65.79 -36.52 83.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.303 -0.248 . . . . 74.11 111.222 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.582 ' HB2' HD21 ' A' ' 5' ' ' LEU . 78.5 mt -57.7 -49.01 77.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.811 0.338 . . . . 72.0 111.555 175.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.71 -38.02 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 N-CA-C 112.3 0.482 . . . . 73.51 112.3 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -69.66 -50.31 45.28 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.09 0.404 . . . . 73.45 112.09 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -85.41 1.8 47.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.69 0.281 . . . . 72.14 111.342 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 141' ' ' ARG . 23.2 mtp85 51.59 52.75 14.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.078 -0.51 . . . . 75.31 110.919 -175.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -41.89 -58.04 3.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 114.994 0.758 . . . . 50.22 114.994 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -64.25 -20.25 65.92 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 117.512 0.656 . . . . 72.01 112.629 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -86.52 -57.8 2.86 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.942 0.401 . . . . 74.2 111.511 172.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.3 -34.73 89.26 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.363 -0.38 . . . . 63.24 114.007 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -58.12 -37.62 74.93 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.091 0.472 . . . . 65.54 111.708 177.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.669 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.7 t -72.36 -47.81 50.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 116.203 -0.453 . . . . 73.41 111.928 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -68.51 -28.09 66.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.02 0.438 . . . . 73.4 111.166 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -55.38 -50.84 68.67 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.022 -0.536 . . . . 64.41 110.866 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.58 -25.97 24.7 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.124 -0.489 . . . . 61.51 111.922 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.421 ' HB3' ' NE2' ' A' ' 159' ' ' HIS . 77.8 t60 71.31 106.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.83 0.852 . . . . 61.21 112.242 -175.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.537 HG12 ' HG2' ' A' ' 153' ' ' GLU . 51.7 t -142.05 -73.89 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.977 -0.556 . . . . 73.44 110.925 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.662 ' HB2' ' HB2' ' A' ' 39' ' ' LYS . 22.0 mm-40 -113.32 23.64 13.04 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.098 0.475 . . . . 75.4 111.534 -177.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.85 134.48 33.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.284 -0.417 . . . . 62.42 111.418 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.473 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -77.76 -11.08 59.85 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 71.4 111.347 176.089 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -68.21 -40.05 82.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.878 0.37 . . . . 71.25 111.225 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 66.08 58.26 9.23 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.252 -0.431 . . . . 73.02 113.729 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -163.2 -172.75 31.07 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 120.813 -0.708 . . . . 33.31 113.473 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' HIS . . . . . 0.421 ' NE2' ' HB3' ' A' ' 151' ' ' HIS . 66.2 m80 -137.96 93.59 2.79 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.868 0.366 . . . . 71.14 111.165 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -91.99 76.32 5.48 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.335 0.588 . . . . 70.25 110.479 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -84.68 95.78 9.01 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.307 -0.406 . . . . 75.31 111.163 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -90.69 123.8 34.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.789 0.328 . . . . 45.33 111.052 177.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -142.02 141.58 32.84 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.645 0.26 . . . . 74.13 110.968 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.735 -0.65 . . . . 62.55 111.431 177.903 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 120.84 0.353 . . . . 60.15 110.894 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -172.33 178.8 2.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.151 -0.477 . . . . 73.02 111.065 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -83.58 148.31 27.24 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.15 0.5 . . . . 74.3 111.553 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -58.97 -43.28 91.34 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.139 0.495 . . . . 74.5 111.481 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.9 tp -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.98 -0.555 . . . . 74.21 111.084 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -62.01 -43.34 99.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.952 176.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' ARG . 16.5 mmt180 -69.08 -39.43 79.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.472 0.545 . . . . 64.03 112.472 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -60.84 -49.54 77.08 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.12 0.486 . . . . 71.32 110.742 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.8 m -61.89 -47.31 85.56 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.079 -0.51 . . . . 75.32 111.117 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.47 -37.8 79.14 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.395 -0.366 . . . . 63.32 111.225 177.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.72 -53.68 55.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.332 0.587 . . . . 61.13 110.763 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -63.77 -49.77 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.662 -0.699 . . . . 75.23 111.754 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.3 mt -63.72 -52.12 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 112.146 0.425 . . . . 71.24 112.146 -177.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.6 t -57.17 -48.37 78.89 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-O 120.964 0.411 . . . . 72.14 111.843 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.408 ' NH2' ' O ' ' A' ' 28' ' ' LYS . 57.3 mtp180 -63.4 -40.3 96.84 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.308 -0.405 . . . . 74.14 111.629 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -60.29 -53.33 58.9 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.869 0.366 . . . . 74.32 111.089 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.7 mp -54.92 -39.95 69.34 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.743 0.306 . . . . 65.04 111.293 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -57.22 10.78 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.546 -0.297 . . . . 65.42 111.662 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -61.48 -32.38 72.38 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.0 0.428 . . . . 72.22 111.285 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.423 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 25.4 mm-40 -65.85 -33.98 77.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.176 -0.466 . . . . 72.02 111.852 175.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.98 -41.1 71.45 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.912 0.386 . . . . 71.33 111.433 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.9 p -86.96 -20.75 26.85 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.004 0.43 . . . . 54.35 111.84 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.27 26.13 66.8 Favored Glycine 0 CA--C 1.524 0.65 0 C-N-CA 121.294 -0.479 . . . . 75.01 112.591 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.75 131.8 26.24 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.266 0.227 . . . . 63.42 111.223 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -47.82 146.18 2.5 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.589 0.959 . . . . 74.15 113.589 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.67 170.29 12.61 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.834 -0.621 . . . . 73.34 110.97 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -151.03 22.46 0.76 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.811 0.671 . . . . 74.1 112.811 -177.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -92.08 161.82 32.18 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 122.471 0.308 . . . . 75.54 111.573 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -68.26 148.96 75.4 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 122.559 2.172 . . . . 65.43 112.053 172.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.475 ' SD ' ' HB3' ' A' ' 37' ' ' SER . 9.2 mmt -90.99 78.5 5.96 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.679 0.992 . . . . 71.22 113.679 -175.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 32.41 -116.6 0.11 Allowed Glycine 0 CA--C 1.533 1.172 0 CA-C-N 114.97 -1.014 . . . . 71.21 115.354 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 31.6 ttm180 -117.49 5.09 12.45 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.282 0.563 . . . . 64.41 111.361 -178.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.7 m -113.41 -12.44 12.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.501 0.556 . . . . 43.23 112.501 -173.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 52.63 -111.98 1.89 Allowed Glycine 0 CA--C 1.534 1.235 0 N-CA-C 114.633 0.613 . . . . 72.14 114.633 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.79 73.35 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.931 0.715 . . . . 43.22 112.931 -173.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.0 m -54.29 -51.23 65.27 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.129 0.49 . . . . 73.2 111.581 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.475 ' HB3' ' SD ' ' A' ' 30' ' ' MET . 66.8 m -63.6 -35.5 80.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.076 -0.511 . . . . 73.31 111.981 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.436 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 61.3 ttt180 -66.04 -55.79 14.84 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.83 0.348 . . . . 75.43 111.066 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE2' HG11 ' A' ' 147' ' ' VAL . 59.0 mtpt -55.95 -42.29 75.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.085 -0.507 . . . . 71.13 111.352 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.63 -45.57 91.6 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.319 -0.401 . . . . 61.34 111.287 174.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.07 -54.85 35.6 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.892 0.377 . . . . 63.34 111.977 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -66.87 -30.79 71.04 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.919 0.34 . . . . 73.23 111.919 -178.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.552 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -69.72 -40.91 75.97 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.093 -0.38 . . . . 64.13 110.748 174.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.2 mt -53.99 -37.29 63.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.217 0.532 . . . . 74.4 110.595 171.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -68.18 -52.75 30.95 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.146 -0.479 . . . . 72.1 111.712 175.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.545 ' NE ' ' HA ' ' A' ' 43' ' ' THR . 3.2 ptp180 -66.24 -21.65 66.3 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.634 0.605 . . . . 61.03 112.634 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 43' ' ' THR . 23.3 m -110.09 -33.79 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 122.057 -0.402 . . . . 72.21 111.885 176.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.43 -32.57 71.77 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 121.5 -0.381 . . . . 61.45 113.947 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 28.3 t70 -61.9 -52.15 65.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 117.401 0.601 . . . . 74.02 110.757 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.41 -41.53 95.27 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.47 -0.395 . . . . 65.33 112.977 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 47' ' ' VAL . 69.8 t -59.89 -49.65 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 120.8 0.333 . . . . 74.23 111.084 175.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 44.5 mt-30 -57.16 -35.98 70.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.585 -0.28 . . . . 52.03 111.508 177.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.4 mmm180 -58.01 -59.76 4.78 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.795 0.331 . . . . 42.15 111.872 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -74.93 -19.29 60.19 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.095 0.406 . . . . 73.33 112.095 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.471 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 56.7 m80 -90.99 -22.81 20.62 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.529 0.566 . . . . 71.53 112.529 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.49 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 30.0 tt0 -54.56 -51.75 64.24 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.787 0.327 . . . . 64.52 111.818 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -53.37 -29.88 36.76 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.096 0.474 . . . . 73.44 111.771 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.48 -53.86 5.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.073 0.463 . . . . 73.1 111.556 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 15.1 m-85 -58.94 -30.01 67.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.498 0.555 . . . . 74.34 112.498 -177.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -51.16 -40.98 59.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 120.956 0.408 . . . . 75.25 111.404 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.469 ' HA2' ' CZ ' ' A' ' 64' ' ' ARG . . . -61.96 -28.41 70.31 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 121.203 -0.523 . . . . 75.14 113.158 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 81.1 mtp -89.51 -33.23 16.84 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.378 0.608 . . . . 71.33 110.335 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.0 tp -63.46 -41.37 98.61 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.744 -0.662 . . . . 62.54 111.449 -176.358 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.469 ' CZ ' ' HA2' ' A' ' 61' ' ' GLY . 13.3 ptt180 -67.84 -26.0 65.83 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.267 -0.424 . . . . 74.53 111.196 176.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.14 -32.66 56.5 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.069 0.462 . . . . 73.42 111.256 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.75 -73.13 0.41 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.075 -0.511 . . . . 72.3 111.531 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.1 t70 45.35 83.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.438 0.637 . . . . 64.5 111.735 -175.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.473 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.0 mp -64.95 114.62 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 115.9 -0.591 . . . . 64.15 112.17 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.89 -8.06 19.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 111.872 0.323 . . . . 61.13 111.872 175.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.3 p-10 -165.6 170.39 14.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.795 0.331 . . . . 60.52 111.738 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HG2' ' HE2' ' A' ' 75' ' ' LYS . 42.5 tt0 -57.22 -28.55 62.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.315 0.487 . . . . 63.35 112.315 -177.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.98 -39.8 75.32 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 122.183 -0.323 . . . . 70.25 111.768 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 33.5 m-20 -60.97 -43.09 99.26 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.499 0.666 . . . . 74.42 109.742 175.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 121' ' ' LEU . 69.4 t -58.87 -38.29 72.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.301 -0.863 . . . . 74.34 111.561 175.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.414 ' HE2' ' HG2' ' A' ' 71' ' ' GLU . 74.5 mmtt -64.7 -40.77 95.94 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.992 0.425 . . . . 71.15 110.729 176.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 t -64.61 -33.82 76.81 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.26 -0.427 . . . . 73.23 111.136 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.7 mt -55.82 -33.34 64.37 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.499 -0.319 . . . . 73.51 111.712 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.3 t -54.7 -39.47 68.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.864 0.364 . . . . 73.24 111.123 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -58.86 -47.58 84.39 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.281 -0.418 . . . . 65.23 111.375 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.34 -40.71 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.066 0.46 . . . . 75.23 111.112 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.516 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.1 mmt -57.82 -40.27 79.59 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.973 -0.558 . . . . 75.35 111.565 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 75.9 mt -57.78 -37.1 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 121.081 0.467 . . . . 55.42 111.085 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -72.29 -27.51 62.51 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.414 -0.357 . . . . 74.34 111.631 177.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 84.9 t -57.45 -38.36 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 120.907 0.384 . . . . 60.22 111.26 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.446 ' CE2' HD22 ' A' ' 98' ' ' LEU . 39.6 m-85 -83.53 10.51 8.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.547 0.573 . . . . 74.42 112.547 178.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.4 t -65.96 -26.65 67.66 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.095 0.474 . . . . 62.3 110.838 176.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -81.55 111.33 17.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.109 -0.496 . . . . 63.32 110.626 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.72 47.69 1.3 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 121.263 -0.494 . . . . 42.23 114.274 -172.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.5 t -79.81 -17.08 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 122.285 -0.538 . . . . 54.3 111.165 176.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 51.1 p 54.22 24.95 5.32 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.101 0.778 . . . . 64.14 113.101 175.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -84.88 11.18 9.81 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.703 0.631 . . . . 65.53 112.703 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.3 m95 68.19 -25.89 0.13 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 112.92 0.711 . . . . 73.14 112.92 -176.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.63 55.65 Favored Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.998 -0.439 . . . . 61.32 113.072 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.789 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.1 mmp_? -62.73 -34.59 77.49 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.535 -0.391 . . . . 60.13 111.275 174.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.3 mm -61.93 -45.94 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.207 0.527 . . . . 51.15 109.876 174.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.0 t -57.71 -42.96 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.746 -0.661 . . . . 45.13 110.967 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.4 m -57.7 -48.2 80.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.382 -0.372 . . . . 65.13 111.137 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.517 ' HG ' HG23 ' A' ' 125' ' ' ILE . 37.3 tp -60.02 -54.39 46.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.152 0.501 . . . . 71.32 111.847 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.6 mt -69.62 -34.19 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 CA-C-N 116.284 -0.416 . . . . 63.5 111.921 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.553 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 97.3 p -63.83 -47.37 81.04 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.397 -0.189 . . . . 74.55 111.437 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 24.5 t80 -59.7 -41.14 90.1 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.797 0.332 . . . . 74.42 110.833 176.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.64 -45.12 95.14 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.872 -0.68 . . . . 73.23 112.452 175.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB1' ' HG3' ' A' ' 20' ' ' GLN . . . -65.41 -34.6 78.67 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.178 0.514 . . . . 72.33 111.465 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 58.5 t80 -63.13 -48.35 78.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.895 -0.593 . . . . 74.44 111.321 175.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 101' ' ' PHE . 52.7 t -66.76 -37.36 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.622 -0.263 . . . . 75.54 110.824 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.38 -44.01 68.29 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.992 0.425 . . . . 64.42 111.428 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -55.12 -47.4 75.08 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.157 0.503 . . . . 62.11 110.956 173.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.455 ' O ' HG12 ' A' ' 112' ' ' ILE . 64.8 t60 -65.45 -34.02 77.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.181 -0.463 . . . . 74.11 111.586 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 86.7 mt -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.52 0.2 . . . . 74.21 111.084 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -59.27 -41.75 89.59 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.033 0.444 . . . . 62.41 110.479 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 61.1 m -54.05 -45.52 71.69 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.92 -0.582 . . . . 64.12 111.83 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -93.63 17.46 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 112.097 0.406 . . . . 41.31 112.097 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 71.48 6.62 5.79 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.367 0.877 . . . . 72.34 113.367 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -81.7 45.42 0.89 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.886 0.374 . . . . 74.22 111.389 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -55.54 -43.02 75.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.994 0.518 . . . . 74.42 111.573 -176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.7 p -62.38 -34.56 76.94 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.418 -0.355 . . . . 71.52 111.938 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.2 m -59.43 -26.0 64.81 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.446 0.536 . . . . 75.54 112.446 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.2 mt -53.87 -39.57 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 112.437 0.532 . . . . 62.2 112.437 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.1 -56.77 10.37 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.752 0.649 . . . . 73.12 112.752 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.3 -28.52 72.33 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 121.714 1.609 . . . . 73.54 112.289 176.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.487 ' HA ' HG13 ' A' ' 74' ' ' VAL . 6.4 tt -66.3 -46.58 76.47 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.958 0.409 . . . . 75.25 110.071 174.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.252 -0.431 . . . . 62.41 111.326 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.17 -47.06 81.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.301 -0.409 . . . . 74.53 111.079 175.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.5 m -55.81 -44.36 77.79 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 120.873 0.368 . . . . 53.42 111.23 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.517 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.9 mm -59.57 -53.5 47.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.172 0.511 . . . . 53.41 111.136 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.8 m -63.0 -36.09 82.41 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.892 -0.594 . . . . 75.55 111.584 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 28.5 t70 -61.08 -52.32 65.4 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.517 -0.31 . . . . 74.04 111.389 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 81' ' ' MET . 61.5 t -64.43 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.187 0.518 . . . . 73.51 110.972 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.544 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.5 tp -55.99 -52.85 62.71 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.765 -0.652 . . . . 71.53 111.067 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 58.7 t -76.09 -24.26 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 115.944 -0.571 . . . . 75.35 111.512 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.9 tpt180 -57.36 -45.55 84.26 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.246 0.461 . . . . 73.44 112.246 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' HD2' ' A' ' 133' ' ' LYS . 2.4 t -114.86 -30.75 6.33 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.906 1.076 . . . . 65.43 113.906 -172.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.436 ' HD2' ' C ' ' A' ' 132' ' ' THR . 13.2 mptt -116.88 29.78 7.72 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.086 0.773 . . . . 72.2 113.086 -176.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.513 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 58.2 ttp180 -60.92 -54.6 43.09 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 120.919 0.39 . . . . 75.43 111.877 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -59.68 -36.74 77.08 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.226 -0.443 . . . . 54.11 111.542 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -69.71 -36.82 76.24 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.752 0.279 . . . . 74.24 111.752 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 129' ' ' LEU . 38.2 mt -57.47 -44.97 85.3 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 111.721 0.267 . . . . 70.12 111.721 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.0 p -78.25 -43.23 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 112.364 0.505 . . . . 63.34 112.364 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -68.59 -36.74 79.12 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.834 0.679 . . . . 74.12 112.834 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -101.13 3.23 40.99 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.178 -0.327 . . . . 74.51 111.531 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 49.65 63.97 1.95 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.043 0.449 . . . . 74.55 110.574 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.09 -47.01 6.46 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 115.114 0.806 . . . . 75.2 115.114 -171.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -75.09 -20.59 59.41 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.676 0.621 . . . . 62.11 112.676 -175.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -84.44 -51.44 6.93 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.054 0.454 . . . . 75.43 110.466 170.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.568 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.91 -32.45 66.35 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.902 -0.59 . . . . 71.43 113.012 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -58.22 -39.91 80.31 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.148 0.499 . . . . 73.33 110.983 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE2' ' A' ' 39' ' ' LYS . 60.4 t -73.16 -40.46 57.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 116.12 -0.491 . . . . 60.01 111.774 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.568 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 13.7 pt-20 -73.39 -33.85 65.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 111.897 0.332 . . . . 71.24 111.897 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.53 -45.72 92.81 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 62.33 111.603 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -82.3 -9.94 59.29 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.821 0.343 . . . . 73.34 111.311 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 54.78 86.71 0.05 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.687 0.756 . . . . 73.45 111.774 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 74.8 t -94.43 -61.3 2.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.24 -0.891 . . . . 74.22 111.819 -174.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -108.39 10.92 27.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.303 0.573 . . . . 72.51 111.21 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.27 124.57 19.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.84 0.681 . . . . 63.14 112.84 -178.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.448 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -62.62 -21.81 65.94 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.179 -0.464 . . . . 63.32 111.42 173.873 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -75.31 -64.85 0.97 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.377 0.608 . . . . 74.0 111.474 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 108.87 -147.81 16.79 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-N 115.655 -0.702 . . . . 43.42 111.796 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 87.63 124.24 1.96 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.875 -0.678 . . . . 73.43 113.483 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -142.0 146.9 36.1 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 122.428 -0.454 . . . . 64.0 110.74 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -73.46 86.05 1.53 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 120.983 0.421 . . . . 71.4 111.64 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -118.14 22.88 11.95 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.369 0.604 . . . . 73.42 110.724 176.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -163.45 102.65 0.94 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.525 -0.761 . . . . 75.52 110.059 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -120.17 127.7 52.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.069 0.462 . . . . 65.25 112.052 -175.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.84 -0.6 . . . . 65.33 111.083 174.78 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.481 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.475 0 CA-C-O 120.592 0.234 . . . . 72.3 110.75 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -66.35 146.99 53.96 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.298 0.571 . . . . 75.32 112.211 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -91.07 146.0 24.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.943 -0.571 . . . . 75.01 110.294 170.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 -38.35 53.04 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.465 0.65 . . . . 65.55 111.055 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.436 HD21 ' CB ' ' A' ' 137' ' ' LEU . 63.3 tp -68.82 -35.79 77.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.404 -0.816 . . . . 54.41 112.13 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -69.8 -43.85 71.24 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.981 0.419 . . . . 73.24 110.175 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -59.62 -51.69 68.75 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.048 -0.524 . . . . 61.0 111.418 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -61.57 -52.2 65.41 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.73 0.3 . . . . 61.21 111.75 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.4 m -56.33 -45.48 80.32 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.684 0.278 . . . . 75.22 111.098 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.66 -41.51 95.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.701 0.286 . . . . 75.52 111.279 176.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -60.58 -48.49 81.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.039 0.447 . . . . 71.52 110.748 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.569 HG12 ' HE3' ' A' ' 30' ' ' MET . 69.5 mt -60.77 -54.12 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 121.109 0.48 . . . . 74.34 111.616 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.476 ' O ' HD13 ' A' ' 17' ' ' LEU . 88.8 mt -61.21 -52.02 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.034 -0.53 . . . . 71.24 111.68 -178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.8 t -53.58 -47.53 70.03 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.824 0.345 . . . . 71.43 111.197 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 11.1 mtp180 -56.2 -55.62 30.9 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.379 -0.373 . . . . 51.41 111.568 176.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -54.83 -43.78 73.32 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.674 0.274 . . . . 75.54 111.473 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.528 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.8 mp -59.95 -43.54 94.96 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.756 0.313 . . . . 64.02 111.204 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.65 -50.41 67.2 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.798 0.333 . . . . 64.14 111.619 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 25.9 mt-10 -60.44 -38.63 84.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.056 0.455 . . . . 62.21 111.388 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 29.0 mm-40 -69.83 -46.1 66.38 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.312 -0.403 . . . . 73.32 111.889 176.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.7 81.22 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.1 0.407 . . . . 71.55 112.1 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.7 p -87.45 -28.22 22.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.707 0.289 . . . . 60.4 111.77 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.26 35.14 27.53 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.082 -0.58 . . . . 53.32 112.682 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -152.46 -173.19 4.47 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.403 0.281 . . . . 65.42 110.933 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -97.78 142.94 28.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.114 0.483 . . . . 74.45 111.542 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -100.64 167.57 10.25 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.926 -0.579 . . . . 62.11 110.666 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.9 t -141.87 33.08 1.58 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.378 0.609 . . . . 73.31 112.056 -177.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -73.65 139.04 77.27 Favored Pre-proline 0 N--CA 1.473 0.708 0 O-C-N 122.105 -0.372 . . . . 64.41 111.257 175.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -53.89 122.63 11.71 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.851 2.367 . . . . 71.22 112.777 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.569 ' HE3' HG12 ' A' ' 12' ' ' ILE . 3.5 tpt -75.68 169.79 17.44 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 112.779 0.659 . . . . 64.15 112.779 -171.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.39 -174.21 18.98 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 114.958 0.743 . . . . 51.5 114.958 -174.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.508 ' HD3' ' N ' ' A' ' 33' ' ' SER . 0.1 OUTLIER -53.12 -43.91 67.26 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.275 0.843 . . . . 64.34 113.275 -175.093 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.508 ' N ' ' HD3' ' A' ' 32' ' ' ARG . 74.6 m -86.37 93.29 9.07 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.927 -0.483 . . . . 64.04 110.554 174.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.67 -68.19 1.81 Allowed Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.363 -0.381 . . . . 72.2 113.718 -175.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -49.21 71.15 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 111.842 0.312 . . . . 71.23 111.842 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 33' ' ' SER . 77.7 m -54.63 -46.81 73.98 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.745 0.307 . . . . 72.34 111.806 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.7 m -65.02 -35.63 81.8 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.633 0.254 . . . . 63.42 111.579 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.452 ' NH1' ' HB3' ' A' ' 42' ' ' GLU . 18.1 tpt85 -64.81 -50.47 66.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.818 0.342 . . . . 61.15 110.663 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.497 ' HE3' ' HB3' ' A' ' 153' ' ' GLU . 54.4 mtpt -59.69 -43.63 93.98 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.809 -0.632 . . . . 72.42 111.35 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.14 81.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.97 0.414 . . . . 73.42 111.215 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HG ' HH21 ' A' ' 45' ' ' ARG . 49.0 tp -61.49 -36.76 81.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.277 -0.419 . . . . 63.02 111.852 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HB3' ' NH1' ' A' ' 38' ' ' ARG . 15.8 pt-20 -78.99 -37.8 38.35 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.134 -0.354 . . . . 75.45 111.137 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.526 HG23 HG21 ' A' ' 152' ' ' VAL . 95.4 m -63.12 -35.23 79.58 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.893 0.378 . . . . 74.3 110.808 175.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -56.81 -32.76 66.04 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.983 0.421 . . . . 61.31 111.161 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.439 HH21 ' HG ' ' A' ' 41' ' ' LEU . 32.2 mtt-85 -79.07 -43.72 23.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.078 0.466 . . . . 75.23 110.415 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -44.8 59.84 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.588 -0.733 . . . . 75.51 112.324 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 34.0 m -106.81 -34.49 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 112.267 0.469 . . . . 71.02 112.267 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.78 -39.64 97.73 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.28 -0.486 . . . . 61.51 113.473 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.35 -56.33 23.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.936 0.398 . . . . 74.32 110.974 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.38 -48.17 77.59 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-N 116.034 -0.53 . . . . 73.42 112.797 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.4 t -57.45 -50.86 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 O-C-N 122.851 -0.205 . . . . 75.13 111.216 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -53.84 -46.91 71.34 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.689 0.255 . . . . 72.51 111.689 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -60.86 -45.69 93.55 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.857 0.688 . . . . 71.02 112.857 -176.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -84.76 -21.2 30.08 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.692 -0.63 . . . . 54.11 112.052 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 31.2 m80 -90.4 -18.29 25.71 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.322 0.489 . . . . 74.53 112.322 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 40.6 tt0 -49.07 -46.04 43.91 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.558 0.577 . . . . 74.34 112.558 -174.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.2 t -56.17 -35.28 67.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.907 0.384 . . . . 32.42 111.965 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.57 -44.01 21.9 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.811 0.338 . . . . 72.24 111.737 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -59.9 -47.33 86.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.605 -0.27 . . . . 64.33 111.35 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.483 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 75.4 mm-40 -53.15 -38.19 62.49 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.87 0.367 . . . . 61.22 111.028 176.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.24 -41.21 86.31 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.03 -0.605 . . . . 64.44 112.313 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 39.9 mtm -72.78 -34.13 66.73 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.483 -0.422 . . . . 72.51 111.148 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.0 -33.62 73.54 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.647 0.261 . . . . 75.14 110.916 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 47.3 mtm180 -68.83 -17.3 63.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.156 0.503 . . . . 70.21 111.239 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -95.6 -20.35 19.04 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 72.24 110.917 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.6 mt -99.83 -82.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.06 -0.518 . . . . 51.11 111.865 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.7 t0 48.63 98.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.702 0.763 . . . . 63.21 111.97 -172.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.459 HD12 ' N ' ' A' ' 68' ' ' ILE . 1.6 mp -76.32 123.81 33.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 115.614 -0.721 . . . . 74.0 111.904 -175.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.25 -5.55 13.63 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.22 0.452 . . . . 52.43 112.22 177.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 19.5 p-10 -167.35 174.14 8.28 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.924 0.392 . . . . 71.43 111.625 173.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.08 -38.91 58.79 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.434 0.531 . . . . 74.15 112.434 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -51.3 -41.79 60.74 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.241 0.459 . . . . 75.24 112.241 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.451 ' HB2' HG23 ' A' ' 68' ' ' ILE . 20.5 m-20 -63.21 -43.11 99.04 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.889 0.376 . . . . 70.4 110.647 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.527 HG21 ' HB3' ' A' ' 117' ' ' SER . 72.6 t -56.38 -43.43 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.92 -0.582 . . . . 73.35 110.993 177.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -73.07 -29.38 62.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.186 -0.461 . . . . 64.44 111.511 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.8 m -68.39 -28.67 67.31 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.933 0.397 . . . . 41.42 110.851 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 86.7 mt -55.67 -28.38 55.18 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.339 -0.391 . . . . 74.21 111.452 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 82' ' ' ILE . 81.3 p -52.13 -35.27 47.85 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 120.798 0.333 . . . . 74.12 111.373 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -61.75 -45.55 93.42 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.99 0.424 . . . . 52.45 110.713 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 82.4 t -64.16 -42.79 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.141 0.496 . . . . 74.03 110.354 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.472 ' SD ' HD12 ' A' ' 98' ' ' LEU . 21.7 mmt -56.17 -38.93 71.59 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.709 -0.678 . . . . 70.42 111.673 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 78' ' ' SER . 85.0 mt -64.37 -41.24 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.098 0.475 . . . . 74.14 110.911 174.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -64.73 -27.93 69.24 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.046 0.388 . . . . 65.34 112.046 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.0 t -55.28 -34.63 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 121.016 0.436 . . . . 44.33 111.911 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -79.82 42.45 0.54 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 112.057 0.392 . . . . 73.42 112.057 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.3 t -129.64 36.05 4.13 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.133 0.492 . . . . 75.21 111.521 -175.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.514 ' OD1' ' HB3' ' A' ' 94' ' ' ARG . 1.5 m-20 -57.91 -28.82 64.58 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.793 0.664 . . . . 64.22 112.793 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 90.79 -10.08 75.85 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.058 -0.591 . . . . 64.55 111.994 -171.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.8 m -139.61 136.97 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 123.387 0.675 . . . . 62.31 110.261 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 t -75.15 96.26 3.24 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.637 0.732 . . . . 71.23 111.552 -177.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -132.15 -172.55 2.91 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.862 -0.608 . . . . 63.21 111.443 -176.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.439 ' HE3' HG13 ' A' ' 95' ' ' ILE . 79.4 m95 -102.09 3.62 38.82 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.964 0.411 . . . . 73.52 110.701 171.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.64 -41.36 99.83 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.311 -0.404 . . . . 71.34 112.589 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.514 ' HB3' ' OD1' ' A' ' 87' ' ' ASP . 19.6 ptt180 -51.77 -38.14 54.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.901 0.381 . . . . 75.02 111.636 171.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.439 HG13 ' HE3' ' A' ' 92' ' ' TRP . 36.9 mm -69.6 -43.21 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.987 0.423 . . . . 63.42 110.561 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.69 -53.19 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.199 -0.455 . . . . 74.14 111.029 175.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.9 m -57.79 -45.0 86.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.226 -0.443 . . . . 64.0 111.504 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 26.7 tp -57.33 -54.63 44.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.167 0.508 . . . . 54.24 111.631 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.84 -41.94 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.236 -0.438 . . . . 74.54 111.739 -178.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.9 m -63.02 -41.18 99.48 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.674 0.273 . . . . 53.23 111.391 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 105' ' ' VAL . 29.5 t80 -68.89 -40.15 79.36 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.681 0.277 . . . . 74.14 110.742 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.17 -48.01 83.24 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 120.834 -0.698 . . . . 23.22 112.221 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.528 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.9 -35.13 80.14 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.136 0.494 . . . . 62.2 111.374 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.416 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 44.2 t80 -61.83 -50.89 70.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.905 -0.588 . . . . 73.15 110.919 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 101' ' ' PHE . 59.3 t -62.33 -38.54 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 116.33 -0.395 . . . . 73.41 110.815 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.33 -41.01 71.89 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.871 0.367 . . . . 43.54 111.618 176.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 95.8 mttt -58.06 -44.87 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.057 0.456 . . . . 71.05 111.046 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.407 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -67.64 -36.46 80.83 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.346 -0.388 . . . . 75.54 111.163 177.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.48 -50.36 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.611 0.243 . . . . 72.53 111.556 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -60.92 -40.83 94.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.047 0.451 . . . . 63.24 110.712 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.1 m -58.81 -39.13 80.26 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.154 -0.475 . . . . 75.14 112.239 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.407 HG12 ' O ' ' A' ' 108' ' ' HIS . 38.5 pt -94.55 17.2 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.654 0.613 . . . . 71.34 112.654 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 71.74 12.59 6.28 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.747 0.647 . . . . 63.04 112.747 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -97.95 31.65 2.62 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.324 . . . . 74.14 111.347 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.446 ' HG3' HD12 ' A' ' 118' ' ' ILE . 38.4 tt0 -56.74 -35.64 68.84 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.196 0.443 . . . . 61.31 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.7 m -56.56 -27.51 57.93 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.026 0.441 . . . . 73.42 111.576 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.527 ' HB3' HG21 ' A' ' 74' ' ' VAL . 53.4 m -71.26 -25.82 62.63 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.405 0.521 . . . . 62.12 112.405 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.446 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.6 mt -53.59 -46.74 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 113.08 0.77 . . . . 75.12 113.08 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.58 -54.08 32.83 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 112.497 0.555 . . . . 63.3 112.497 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.19 -26.44 69.64 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.575 1.516 . . . . 71.4 112.492 174.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.425 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.4 tt -67.36 -44.65 78.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.717 -0.475 . . . . 74.53 109.717 173.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.466 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.16 -37.79 78.18 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.074 0.464 . . . . 71.43 111.099 174.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.14 -38.64 91.27 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.116 -0.493 . . . . 73.41 110.682 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.0 m -63.05 -44.17 96.58 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 120.815 0.341 . . . . 63.35 111.136 175.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 47.5 mm -56.34 -53.04 44.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.179 0.514 . . . . 71.01 110.656 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -63.7 -35.77 81.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.737 -0.665 . . . . 74.22 111.55 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 27.0 t70 -62.88 -52.06 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.539 -0.3 . . . . 71.35 111.396 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 65.0 t -62.23 -46.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.163 0.506 . . . . 73.35 110.442 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.7 tp -49.94 -53.07 28.53 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.526 -0.761 . . . . 65.53 111.673 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.504 HG13 ' HD3' ' A' ' 134' ' ' ARG . 71.2 t -76.92 -32.94 20.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.912 -0.586 . . . . 74.41 112.166 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 16.0 tpt180 -55.26 -33.13 62.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.008 0.432 . . . . 60.44 111.738 -176.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -40.73 3.35 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.672 0.619 . . . . 64.21 112.672 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -101.9 18.94 19.32 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.48 0.918 . . . . 71.4 113.48 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.504 ' HD3' HG13 ' A' ' 130' ' ' VAL . 14.8 tpt180 -47.28 -56.37 6.91 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.591 0.589 . . . . 73.11 112.591 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.35 -42.8 58.78 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.824 0.345 . . . . 70.43 111.069 -177.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -56.43 -37.37 70.13 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.503 -0.317 . . . . 70.22 111.824 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.558 HD11 ' HG ' ' A' ' 129' ' ' LEU . 18.4 mt -55.05 -51.17 67.16 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.421 -0.354 . . . . 72.3 111.924 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.1 p -77.78 -43.06 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.631 -0.668 . . . . 70.22 112.071 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -58.72 -40.59 84.18 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.233 0.457 . . . . 73.15 112.233 -177.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -101.66 10.85 39.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.27 0.557 . . . . 72.21 110.7 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.631 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 23.0 mtm180 67.17 7.21 5.28 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.349 -0.841 . . . . 75.02 113.088 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 137' ' ' LEU . . . 32.21 -82.65 0.0 OUTLIER Glycine 0 N--CA 1.468 0.827 0 N-CA-C 115.711 1.045 . . . . 73.14 115.711 173.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.442 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.2 m95 -70.87 -46.48 62.56 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.341 0.256 . . . . 72.43 111.382 -176.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.631 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 23.7 m-20 -61.85 -39.94 93.59 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.056 0.455 . . . . 73.1 110.025 170.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.55 91.14 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 115.85 -0.614 . . . . 63.3 112.503 176.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -67.14 -44.19 80.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.074 0.55 . . . . 64.3 111.111 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 143' ' ' TRP . 94.8 t -62.96 -44.29 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 116.199 -0.455 . . . . 64.43 111.898 178.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.58 -32.07 63.94 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.675 0.274 . . . . 71.33 111.738 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -55.82 -50.42 70.58 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.954 0.407 . . . . 71.12 111.79 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.18 -14.02 45.27 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.225 -0.443 . . . . 72.45 112.098 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.62 ' HB2' ' HB3' ' A' ' 159' ' ' HIS . 80.2 t60 57.61 79.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.198 0.599 . . . . 72.03 111.569 -173.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.526 HG21 HG23 ' A' ' 43' ' ' THR . 93.1 t -107.09 -68.52 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.858 -0.61 . . . . 70.12 110.334 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.497 ' HB3' ' HE3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -105.77 67.27 0.75 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.543 0.687 . . . . 72.52 110.44 179.7 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -143.68 151.51 40.16 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.646 -0.706 . . . . 74.32 111.116 178.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.484 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -99.68 -23.54 15.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.239 0.829 . . . . 74.04 113.239 -174.427 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -81.59 -52.62 7.02 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.444 0.535 . . . . 71.41 112.444 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 133.09 -103.92 0.52 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 75.21 113.546 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 65.41 -110.29 3.4 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.464 -0.398 . . . . 72.22 113.638 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' HIS . . . . . 0.62 ' HB3' ' HB2' ' A' ' 151' ' ' HIS . 12.2 p-80 58.38 130.16 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.629 1.172 . . . . 64.12 113.218 -179.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -160.04 131.33 5.89 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.627 -0.715 . . . . 75.44 110.829 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -155.37 134.44 12.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.812 0.671 . . . . 73.42 112.812 -178.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 22.1 p-80 -141.46 153.52 45.02 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.344 -0.389 . . . . 72.23 110.325 172.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -136.41 -179.88 5.95 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.691 0.626 . . . . 72.44 112.691 -170.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 118.641 -0.695 . . . . 63.32 111.278 177.99 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.867 0.365 . . . . 61.31 111.395 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.48 156.57 22.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.356 0.598 . . . . 64.13 112.256 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.43 163.94 24.39 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.633 0.605 . . . . 62.03 112.633 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.08 -40.01 60.57 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.532 0.682 . . . . 72.02 110.5 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -58.05 -38.7 76.79 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 115.487 -0.779 . . . . 71.31 111.692 176.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -67.53 -41.18 84.77 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.522 -0.308 . . . . 73.22 110.581 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -53.94 -51.45 63.78 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.769 0.318 . . . . 65.44 111.439 176.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.68 -52.73 59.35 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.056 0.391 . . . . 63.31 112.056 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -57.83 -43.17 85.64 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.283 -0.417 . . . . 73.03 111.389 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.429 HD11 ' HG2' ' A' ' 123' ' ' GLU . 36.3 tp -62.21 -41.78 98.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.55 -0.296 . . . . 64.04 111.673 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -59.25 -51.61 69.22 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.897 0.379 . . . . 64.24 111.412 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.89 -52.51 48.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.201 0.524 . . . . 74.44 111.486 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.18 -42.39 88.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.921 -0.581 . . . . 74.3 111.825 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 t -59.62 -49.59 77.18 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.63 0.252 . . . . 64.45 111.587 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.461 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 67.1 mtt180 -59.23 -48.1 82.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.871 0.367 . . . . 62.5 110.685 177.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -56.82 -54.96 40.37 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.257 -0.429 . . . . 74.11 112.055 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.34 -40.21 81.55 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.791 0.293 . . . . 74.33 111.791 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -63.47 -57.5 10.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 111.907 0.336 . . . . 74.15 111.907 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.2 mm-40 -66.66 -31.32 71.93 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.937 0.399 . . . . 72.34 111.828 -177.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -76.36 -34.48 58.92 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.632 0.253 . . . . 73.24 111.423 179.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.93 -34.54 71.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.168 0.509 . . . . 43.25 110.982 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.3 p -86.95 -22.33 25.68 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.08 -0.509 . . . . 75.43 111.794 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.98 38.5 48.28 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 121.319 -0.467 . . . . 55.13 112.712 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.3 -161.9 1.27 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.143 0.497 . . . . 70.4 111.909 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -148.76 128.5 13.32 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.209 -0.45 . . . . 74.25 110.903 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -88.02 176.33 7.36 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.038 0.447 . . . . 73.14 111.139 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -130.99 26.31 4.93 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.104 0.478 . . . . 61.04 111.505 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -71.46 137.93 83.65 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-O 120.8 0.333 . . . . 73.31 111.708 -178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 134.6 64.6 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.552 2.168 . . . . 73.03 111.879 176.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.0 tpt -73.0 153.6 40.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.899 0.38 . . . . 64.35 111.327 -175.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.76 -167.32 1.44 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 115.33 0.892 . . . . 71.05 115.33 -174.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -53.48 -30.44 40.97 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.861 1.06 . . . . 75.01 113.861 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 37' ' ' SER . 85.7 p -79.84 -12.42 59.76 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.287 0.477 . . . . 64.22 112.287 -177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 61.48 -116.39 9.28 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 116.161 -0.472 . . . . 55.13 113.505 176.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.89 -38.35 70.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.464 0.542 . . . . 54.33 112.464 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.485 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 25.1 m -58.98 -48.07 82.87 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.971 0.415 . . . . 73.03 111.82 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.471 ' HB2' ' OG ' ' A' ' 33' ' ' SER . 35.4 t -64.88 -43.14 93.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.972 0.415 . . . . 70.11 111.065 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -60.84 -54.7 41.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.267 -0.424 . . . . 65.24 112.142 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.485 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 20.8 ptmt -56.03 -41.85 75.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.559 0.218 . . . . 74.01 111.054 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.05 87.77 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.766 0.317 . . . . 73.14 111.524 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.4 tp -58.85 -54.7 44.18 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.524 0.565 . . . . 64.0 112.524 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.05 -27.75 63.87 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.105 -0.372 . . . . 64.42 111.756 -176.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.492 ' O ' HG22 ' A' ' 47' ' ' VAL . 46.8 m -62.75 -45.19 93.86 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 120.827 0.346 . . . . 73.35 110.135 171.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -54.57 -34.65 62.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.29 -0.414 . . . . 73.52 111.719 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -70.73 -52.21 22.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.785 0.326 . . . . 72.41 110.945 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -58.85 -44.27 90.95 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.15 -0.477 . . . . 74.13 112.164 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 43' ' ' THR . 19.5 m -87.98 -33.05 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 120.948 0.404 . . . . 72.01 111.942 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.02 -30.34 74.0 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 114.229 0.451 . . . . 61.12 114.229 -174.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.521 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 29.6 t70 -58.42 -57.61 12.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 117.568 0.684 . . . . 75.21 111.277 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.07 -42.08 98.3 Favored Glycine 0 CA--C 1.526 0.763 0 C-N-CA 121.353 -0.451 . . . . 55.2 113.006 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 47' ' ' VAL . 77.0 t -57.52 -45.47 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 122.593 -0.357 . . . . 73.15 111.067 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -61.27 -43.86 98.19 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.76 -0.2 . . . . 72.5 111.22 175.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 4.3 mmp_? -57.25 -49.4 76.16 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.826 0.346 . . . . 75.24 111.494 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -66.17 -47.65 73.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.155 0.502 . . . . 64.2 111.637 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -73.05 -20.69 60.93 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.943 -0.571 . . . . 71.14 112.453 -176.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -49.1 -54.59 15.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.324 0.491 . . . . 74.21 112.324 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 t -53.24 -36.73 61.39 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.419 0.525 . . . . 75.33 112.419 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.08 14.81 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.014 0.435 . . . . 53.31 111.538 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -60.04 -36.57 77.57 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.342 -0.39 . . . . 73.12 111.882 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.532 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 70.7 mm-40 -47.13 -50.99 19.17 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 120.985 0.421 . . . . 53.24 111.254 176.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.78 -35.47 67.98 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.098 -0.501 . . . . 75.44 113.208 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 45.0 mtm -77.15 -44.59 29.75 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 122.301 -0.529 . . . . 60.24 111.143 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 105' ' ' VAL . 9.1 mp -54.88 -27.73 44.96 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.132 -0.355 . . . . 72.11 111.416 176.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 99.4 mtt180 -65.02 -44.72 88.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.749 0.309 . . . . 73.24 111.562 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.69 -7.07 55.42 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.344 0.498 . . . . 70.34 112.344 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.404 HD13 HD21 ' A' ' 77' ' ' LEU . 96.1 mt -96.35 -71.66 0.67 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.052 0.453 . . . . 74.04 111.209 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t0 47.46 88.85 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.248 -0.887 . . . . 72.32 111.838 -172.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.523 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -73.22 103.09 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.914 -0.584 . . . . 55.14 111.053 -178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.428 ' HD3' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.09 -11.3 16.66 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.101 0.408 . . . . 75.03 112.101 -179.294 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.428 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 1.2 p30 -154.42 176.79 11.91 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.024 0.44 . . . . 72.52 111.978 178.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.1 -39.72 79.36 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.163 -0.471 . . . . 74.12 112.119 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -56.1 -39.87 72.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.483 -0.326 . . . . 73.04 111.747 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.523 ' HB2' HG23 ' A' ' 68' ' ' ILE . 50.8 m-20 -62.23 -39.12 91.76 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.938 0.399 . . . . 73.41 110.711 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 82.2 t -60.87 -46.8 95.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.206 0.526 . . . . 65.35 110.927 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' SER . 99.7 mttt -65.91 -28.78 69.19 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.889 0.376 . . . . 61.14 111.186 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.9 m -67.55 -36.48 81.04 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.791 0.329 . . . . 51.12 110.492 171.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.54 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.7 mt -59.44 -39.98 85.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.668 0.27 . . . . 74.22 110.617 173.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 28.9 t -52.46 -37.02 56.07 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.96 0.409 . . . . 43.23 111.225 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -61.37 -47.27 86.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.947 0.403 . . . . 64.15 110.361 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' HG23 ' A' ' 84' ' ' VAL . 59.7 t -60.89 -42.86 94.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.263 -0.426 . . . . 75.31 110.892 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -54.54 -44.14 72.57 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.131 -0.486 . . . . 64.45 111.238 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 78' ' ' SER . 74.9 mt -61.79 -36.9 76.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.146 0.498 . . . . 64.12 111.137 176.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.456 ' HA ' ' OG ' ' A' ' 86' ' ' SER . 82.6 m-70 -71.65 -27.47 63.1 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.073 0.397 . . . . 64.53 112.073 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 80' ' ' VAL . 94.1 t -58.82 -23.84 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 N-CA-C 111.994 0.368 . . . . 73.25 111.994 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.469 ' CE2' HD22 ' A' ' 98' ' ' LEU . 58.0 m-85 -106.5 9.44 31.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.437 0.532 . . . . 62.13 112.437 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.456 ' OG ' ' HA ' ' A' ' 83' ' ' HIS . 59.2 m -73.52 -5.13 38.22 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.034 0.445 . . . . 70.24 111.863 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.54 -26.08 67.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.393 -0.367 . . . . 61.4 111.986 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.86 86.63 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 121.274 -0.489 . . . . 32.35 114.012 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.0 m -80.77 159.46 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.409 -0.465 . . . . 73.23 111.851 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.1 p -95.17 -4.1 46.64 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 112.2 0.445 . . . . 62.1 112.2 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.71 118.97 5.4 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.563 0.579 . . . . 72.41 112.563 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -67.12 -19.42 65.62 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.285 0.476 . . . . 74.41 112.285 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.47 -27.81 54.61 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 120.978 -0.63 . . . . 70.24 113.506 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.9 mtp85 -65.8 -25.64 67.33 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.52 -0.4 . . . . 74.44 112.0 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.4 mm -57.03 -40.75 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 121.247 0.546 . . . . 71.43 110.16 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.42 -41.45 88.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 116.031 -0.531 . . . . 64.32 110.886 176.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.6 m -57.86 -44.26 86.48 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.859 0.361 . . . . 64.04 111.233 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CE2' ' A' ' 85' ' ' PHE . 31.5 tp -61.39 -54.94 37.19 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.184 0.516 . . . . 70.11 111.693 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.37 -37.01 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.136 -0.484 . . . . 75.1 112.193 -176.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.6 p -64.05 -41.88 97.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.653 -0.249 . . . . 72.45 111.282 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 16.0 t80 -60.17 -43.48 95.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.921 0.391 . . . . 62.11 110.577 175.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.72 -46.42 92.26 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.969 -0.634 . . . . 51.31 112.552 174.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.13 80.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.941 0.401 . . . . 71.33 111.682 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -65.59 -47.98 73.9 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.267 -0.424 . . . . 70.04 111.025 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 101' ' ' PHE . 41.6 t -64.92 -34.24 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.93 0.395 . . . . 74.33 110.546 176.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.09 -39.91 79.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.134 -0.485 . . . . 65.53 111.405 176.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.25 -46.2 83.26 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.15 0.5 . . . . 72.24 110.906 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -62.3 -35.8 80.14 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.988 -0.551 . . . . 71.23 110.937 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.56 HD13 ' HB2' ' A' ' 117' ' ' SER . 98.4 mt -65.29 -45.0 86.18 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.259 -0.428 . . . . 73.42 111.198 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -57.53 -43.57 84.46 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.534 0.207 . . . . 62.41 111.081 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.5 m -54.65 -48.42 72.34 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.988 0.423 . . . . 73.24 111.505 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.8 pt -90.02 17.53 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 112.159 0.429 . . . . 64.23 112.159 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 67.69 9.11 6.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.701 1.0 . . . . 72.24 113.701 174.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.52 43.56 1.12 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.83 -0.544 . . . . 61.3 111.76 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.15 -28.98 70.03 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 122.167 -0.333 . . . . 65.32 111.655 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.0 m -56.41 -27.76 57.41 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.764 0.316 . . . . 73.31 111.499 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.56 ' HB2' HD13 ' A' ' 109' ' ' LEU . 43.9 m -74.43 -26.78 60.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.107 0.41 . . . . 65.12 112.107 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.93 -45.43 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 112.994 0.739 . . . . 62.34 112.994 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.84 -51.48 19.89 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.659 0.615 . . . . 73.41 112.659 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.28 -28.69 85.38 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.638 1.559 . . . . 75.14 111.936 172.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.04 -45.02 82.93 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 109.539 -0.541 . . . . 72.15 109.539 173.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.18 82.99 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.057 0.456 . . . . 71.15 110.905 173.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.429 ' HG2' HD11 ' A' ' 10' ' ' LEU . 40.9 mt-10 -66.23 -32.56 74.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.365 -0.38 . . . . 64.51 111.013 174.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.1 m -65.01 -46.25 82.16 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.946 0.403 . . . . 64.45 110.863 175.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.419 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.1 mm -56.26 -50.76 69.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.427 0.632 . . . . 51.44 110.642 175.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.2 m -64.24 -41.2 97.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.399 -0.819 . . . . 55.22 111.748 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.1 t70 -60.65 -52.01 66.95 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.542 -0.299 . . . . 65.2 110.692 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 81' ' ' MET . 93.2 t -58.04 -44.63 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 121.113 0.482 . . . . 73.25 111.252 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 137' ' ' LEU . 14.0 tp -55.35 -51.98 65.01 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.4 0.619 . . . . 64.14 110.85 178.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 134' ' ' ARG . 90.3 t -75.5 -26.38 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.728 -0.669 . . . . 54.05 112.032 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.3 tpp180 -61.46 -35.27 77.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.924 0.392 . . . . 73.01 111.969 -176.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.7 t -121.79 -33.19 3.62 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.801 0.667 . . . . 63.11 112.801 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.515 ' HG2' HG23 ' A' ' 132' ' ' THR . 46.4 mmtm -114.72 20.53 15.17 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.262 0.838 . . . . 73.3 113.262 -172.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.418 ' HB2' HG13 ' A' ' 130' ' ' VAL . 44.1 ttp180 -56.41 -51.67 67.49 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.089 0.471 . . . . 71.43 111.637 177.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.66 -47.33 84.81 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.922 -0.581 . . . . 71.11 111.123 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -61.67 -37.15 83.02 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 111.611 0.226 . . . . 71.51 111.611 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 129' ' ' LEU . 20.7 mt -58.29 -48.07 81.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.645 -0.252 . . . . 73.34 111.672 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.6 p -78.34 -39.66 24.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 112.161 0.43 . . . . 74.42 112.161 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -67.03 -49.7 64.4 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.413 0.523 . . . . 73.14 112.413 -177.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -94.6 -1.35 53.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.698 0.285 . . . . 75.33 111.482 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.56 ' HD3' ' HB3' ' A' ' 161' ' ' HIS . 19.6 mtp180 55.63 79.02 0.17 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.406 0.622 . . . . 75.32 111.078 -177.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -54.47 -53.28 39.46 Favored Glycine 0 C--N 1.335 0.478 0 CA-C-N 115.244 -0.889 . . . . 64.31 114.28 -173.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -65.55 -40.03 92.38 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.132 0.466 . . . . 75.24 111.88 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 6.4 m-20 -62.2 -58.55 7.34 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.829 0.347 . . . . 75.12 110.866 175.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -59.02 -31.19 68.04 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 121.329 -0.462 . . . . 45.22 112.831 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -58.88 -55.73 31.34 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.167 0.508 . . . . 74.12 111.119 175.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.485 HG21 ' HG3' ' A' ' 39' ' ' LYS . 93.5 t -63.85 -36.83 77.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 116.147 -0.479 . . . . 64.51 111.568 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 55.1 mt-10 -66.82 -39.14 87.58 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.93 0.395 . . . . 73.34 111.236 176.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -61.32 -48.97 78.9 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.903 0.383 . . . . 73.32 111.788 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.46 -22.53 35.16 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.011 0.374 . . . . 63.44 112.011 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.1 t60 61.08 88.16 0.09 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.524 0.678 . . . . 60.3 111.044 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.476 HG21 HG23 ' A' ' 43' ' ' THR . 76.8 t -129.79 -74.93 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 115.717 -0.674 . . . . 62.12 110.689 178.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.481 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 62.7 mm-40 -116.41 79.82 1.37 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.387 0.613 . . . . 73.33 111.563 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -150.52 176.89 10.54 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.684 -0.689 . . . . 74.21 109.903 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.585 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -124.99 -17.25 5.84 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.869 0.692 . . . . 64.23 112.869 -176.568 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 62.18 -1.43 0.39 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.362 0.875 . . . . 73.45 113.362 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -76.87 77.87 1.44 Allowed Glycine 0 CA--C 1.524 0.622 0 C-N-CA 121.077 -0.582 . . . . 72.24 112.206 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 107.65 -153.88 16.71 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 112.004 -0.438 . . . . 72.45 112.004 -175.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -167.1 125.66 1.34 Allowed 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.009 0.433 . . . . 65.01 111.565 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -78.05 29.18 0.17 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 120.874 0.368 . . . . 72.43 111.827 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' HIS . . . . . 0.56 ' HB3' ' HD3' ' A' ' 141' ' ' ARG . 3.3 p-80 -172.1 132.94 0.68 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.911 0.484 . . . . 62.41 110.96 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -89.49 99.9 12.8 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.356 0.598 . . . . 61.42 110.804 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -66.91 148.08 52.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.454 -0.794 . . . . 74.54 112.273 -173.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 11.0 p80 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.807 -0.616 . . . . 74.31 111.172 176.208 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptm . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 112.267 0.469 . . . . 72.44 112.267 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.435 ' HB2' ' NE ' ' A' ' 7' ' ' ARG . 2.9 mp0 -98.98 169.54 9.36 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.573 0.701 . . . . 63.41 112.518 -174.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -94.96 155.42 16.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 115.34 -0.846 . . . . 74.52 108.873 170.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -61.28 -33.69 73.96 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.386 -0.821 . . . . 61.22 111.413 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.48 -35.39 75.78 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.088 0.47 . . . . 60.12 110.497 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -67.27 -36.15 81.0 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.046 -0.525 . . . . 74.23 110.24 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.488 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 4.4 mpt_? -61.98 -51.26 68.79 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.639 -0.255 . . . . 71.14 111.544 176.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.41 -48.01 83.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.018 0.437 . . . . 73.45 111.75 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 p -60.67 -52.81 63.57 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.389 -0.369 . . . . 51.24 111.344 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.9 tp -58.78 -35.96 73.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.008 0.433 . . . . 60.34 111.615 176.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 21.3 tt0 -59.27 -52.93 63.53 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.274 0.559 . . . . 75.31 110.619 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -63.85 -53.96 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 115.646 -0.707 . . . . 74.41 111.774 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.465 ' O ' HD13 ' A' ' 17' ' ' LEU . 82.8 mt -59.16 -49.85 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 112.17 0.433 . . . . 74.15 112.17 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.7 t -55.16 -50.26 69.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 120.853 0.359 . . . . 71.23 111.524 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.686 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 17.7 mtp180 -60.86 -42.78 98.54 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.636 -0.256 . . . . 72.1 111.593 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 85.1 t80 -58.48 -52.86 63.87 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.896 0.379 . . . . 75.42 111.765 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -54.47 -41.2 69.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.879 0.371 . . . . 60.35 111.581 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.434 ' NH2' ' HG3' ' A' ' 119' ' ' GLU . 19.4 mmt85 -65.2 -52.78 52.72 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.352 0.501 . . . . 65.23 112.352 178.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.634 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 11.2 pt-20 -62.39 -34.27 76.38 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.846 0.355 . . . . 75.13 111.955 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 33.3 mm-40 -69.64 -32.02 70.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.882 0.372 . . . . 73.11 111.208 176.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.52 -29.65 61.48 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.37 -0.377 . . . . 71.22 111.921 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.528 HG22 ' HE3' ' A' ' 110' ' ' LYS . 51.5 p -87.17 -30.43 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.826 0.346 . . . . 65.14 111.753 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.89 8.1 67.61 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 121.26 -0.495 . . . . 72.34 112.399 -176.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.97 124.42 8.3 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.797 0.332 . . . . 61.04 111.16 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -58.18 155.5 11.21 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.996 0.739 . . . . 74.45 112.996 -177.869 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -88.22 158.89 18.36 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.203 -0.453 . . . . 62.02 111.253 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.9 t -116.64 -0.35 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.715 0.635 . . . . 70.55 112.715 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -75.7 150.67 84.33 Favored Pre-proline 0 N--CA 1.473 0.708 0 O-C-N 122.172 -0.33 . . . . 73.12 111.784 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -53.59 140.79 64.91 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 122.478 2.119 . . . . 64.53 112.627 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.686 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 57.1 tpp -60.28 -71.08 0.14 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.119 0.414 . . . . 70.02 112.119 -176.27 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 157.37 -115.25 0.65 Allowed Glycine 0 CA--C 1.524 0.648 0 C-N-CA 121.122 -0.561 . . . . 72.0 112.614 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -80.87 -15.53 56.08 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 117.134 0.467 . . . . 72.33 111.88 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.514 ' OG ' ' HB3' ' A' ' 37' ' ' SER . 79.8 p -113.32 133.86 54.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.826 0.346 . . . . 71.12 111.13 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -107.37 -87.81 1.96 Allowed Glycine 0 CA--C 1.531 1.041 0 C-N-CA 121.024 -0.608 . . . . 74.23 113.93 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.48 -50.83 69.85 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.917 0.71 . . . . 62.41 112.917 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.8 m -57.77 -50.76 72.16 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.169 0.433 . . . . 72.02 112.169 -177.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.514 ' HB3' ' OG ' ' A' ' 33' ' ' SER . 79.8 p -57.78 -48.06 80.77 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.566 -0.288 . . . . 73.43 111.703 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.0 ttt-85 -52.97 -54.66 31.84 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.913 0.387 . . . . 71.44 111.288 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -55.86 -48.64 75.17 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.921 -0.582 . . . . 62.2 111.161 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.35 -41.34 98.84 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.273 -0.421 . . . . 71.22 111.829 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.24 -53.39 49.93 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 111.775 0.287 . . . . 71.51 111.775 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -64.35 -31.34 72.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.771 0.32 . . . . 72.35 111.409 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.5 ' O ' HG22 ' A' ' 47' ' ' VAL . 86.2 m -67.17 -44.15 80.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.778 0.323 . . . . 62.04 110.57 174.061 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 39.2 mt -54.9 -44.19 73.93 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.495 0.554 . . . . 64.12 112.495 178.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -72.25 -37.54 69.09 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.538 0.57 . . . . 72.23 112.538 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.411 ' NH1' HG13 ' A' ' 152' ' ' VAL . 16.1 ptm180 -73.77 -41.36 62.56 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.965 -0.46 . . . . 73.13 111.814 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 43' ' ' THR . 17.2 m -79.11 -33.51 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.189 0.518 . . . . 64.55 110.734 176.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -59.68 -50.33 68.91 Favored Glycine 0 C--O 1.225 -0.451 0 CA-C-N 115.74 -0.664 . . . . 50.25 112.751 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -53.87 -46.59 71.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.898 0.349 . . . . 73.34 111.51 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.08 -48.41 79.87 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 121.14 -0.552 . . . . 73.22 112.9 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 54' ' ' ASN . 70.9 t -63.52 -47.08 93.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.909 0.385 . . . . 73.0 111.378 176.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.5 mt-30 -55.18 -47.41 75.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.197 -0.456 . . . . 74.42 111.595 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -57.81 -42.0 83.35 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.11 0.781 . . . . 73.24 113.11 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -84.87 -27.58 26.59 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.821 -0.549 . . . . 70.32 111.906 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -90.72 -18.21 25.41 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.221 0.823 . . . . 74.41 113.221 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 31.7 tt0 -49.15 -51.12 34.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.862 0.689 . . . . 71.31 112.862 -170.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.71 -35.51 70.75 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.051 0.453 . . . . 44.4 111.655 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.05 -49.59 49.69 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.267 -0.424 . . . . 63.32 111.615 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.92 -40.8 98.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.697 0.258 . . . . 74.1 111.697 178.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.592 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 74.7 mm-40 -51.34 -44.7 62.09 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.597 0.237 . . . . 72.41 111.131 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.462 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -51.85 -38.72 46.32 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.229 -0.51 . . . . 61.24 112.826 176.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 84.9 mtp -73.3 -43.21 61.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 54.52 111.121 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.402 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 8.7 mp -57.46 -29.36 64.14 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.15 0.426 . . . . 75.23 112.15 178.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.592 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 53.8 mtm180 -64.51 -10.99 29.43 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.621 0.6 . . . . 74.05 112.621 -178.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -122.3 -0.74 9.29 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.009 0.433 . . . . 73.4 111.424 173.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.1 mt -97.12 -78.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.385 -0.37 . . . . 75.15 110.889 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 68.11 -47.93 0.53 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.161 1.171 . . . . 72.31 114.161 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.446 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.2 mp 65.58 114.82 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.7 0.8 . . . . 74.3 111.938 -177.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.54 -5.41 12.8 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.286 -0.416 . . . . 72.0 111.717 176.458 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -170.46 175.84 4.62 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.714 0.292 . . . . 65.53 111.341 172.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 37.8 tt0 -58.21 -24.04 57.82 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.995 0.369 . . . . 72.33 111.995 -178.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -56.01 -45.25 79.14 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.782 0.325 . . . . 71.33 111.016 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -63.6 -41.28 98.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.113 0.483 . . . . 65.34 110.412 175.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.0 t -56.74 -43.57 79.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 115.997 -0.547 . . . . 72.41 111.323 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 71' ' ' GLU . 65.3 mttm -60.15 -39.66 87.14 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.293 0.568 . . . . 74.1 110.564 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.1 t -66.79 -33.12 74.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.974 -0.557 . . . . 52.33 110.969 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 81' ' ' MET . 85.4 mt -61.01 -37.28 81.98 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.72 0.295 . . . . 54.12 110.798 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -52.75 -41.22 63.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.998 0.427 . . . . 72.31 111.098 177.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 79' ' ' ARG . 16.8 mmt85 -56.23 -44.58 79.7 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.164 0.507 . . . . 74.32 110.749 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.2 t -69.95 -41.08 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.782 -0.644 . . . . 70.14 111.392 178.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.463 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.5 mmt -55.54 -38.82 69.79 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.025 0.441 . . . . 71.14 111.605 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 70.9 mt -58.49 -40.72 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.248 0.547 . . . . 54.13 110.85 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.0 -25.8 60.09 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.912 -0.585 . . . . 64.45 112.47 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 94.9 t -54.0 -25.33 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-O 120.981 0.42 . . . . 75.31 111.709 175.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.614 ' HZ ' HD22 ' A' ' 98' ' ' LEU . 79.2 m-85 -94.87 10.61 34.69 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.474 0.546 . . . . 74.43 112.474 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.7 t -62.84 -10.55 13.6 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.629 0.603 . . . . 65.12 112.629 -176.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.67 -28.7 69.79 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.915 0.388 . . . . 63.42 111.675 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.82 -4.4 7.66 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.297 -0.478 . . . . 63.42 114.071 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.0 m -64.55 150.57 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 112.204 0.446 . . . . 72.35 112.204 -177.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 67.1 p -79.73 -34.37 40.04 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.832 0.349 . . . . 62.13 111.644 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 19.4 m120 -50.68 151.75 2.27 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.011 -0.54 . . . . 73.42 112.416 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.566 ' HE3' HG13 ' A' ' 95' ' ' ILE . 90.9 m95 -81.35 3.15 25.31 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.756 0.65 . . . . 75.14 112.756 -175.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.24 -35.47 70.83 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 121.056 -0.592 . . . . 54.43 112.418 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HG2' ' O ' ' A' ' 91' ' ' ASN . 23.2 ptt180 -56.12 -40.49 73.83 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.865 0.466 . . . . 74.21 111.603 173.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.566 HG13 ' HE3' ' A' ' 92' ' ' TRP . 40.1 mm -67.79 -44.95 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 120.937 0.399 . . . . 73.33 110.563 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.6 t -55.06 -46.32 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 116.099 -0.5 . . . . 74.53 111.118 176.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -58.78 -46.92 86.43 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 65.32 111.597 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.614 HD22 ' HZ ' ' A' ' 85' ' ' PHE . 26.2 tp -57.76 -55.02 40.23 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.213 0.53 . . . . 75.34 111.661 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.8 mt -69.19 -35.89 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.972 -0.558 . . . . 74.23 111.912 -174.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.8 p -68.19 -43.13 78.79 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.56 0.219 . . . . 54.43 111.172 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -63.18 -42.35 99.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.775 0.321 . . . . 73.05 111.101 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.91 -48.1 84.51 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.896 -0.668 . . . . 73.34 112.158 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.427 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.41 -32.49 74.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.152 0.501 . . . . 51.14 111.353 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.466 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 39.3 t80 -63.81 -47.5 80.63 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.895 -0.593 . . . . 73.22 110.832 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.97 -36.39 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.286 -0.416 . . . . 54.3 110.515 175.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.14 -42.5 69.61 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.279 -0.418 . . . . 73.11 111.759 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -56.68 -49.11 76.06 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.438 0.637 . . . . 73.22 110.706 175.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -61.18 -33.47 73.49 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.492 -0.776 . . . . 71.32 111.07 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.35 -49.57 54.36 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.429 -0.35 . . . . 63.11 111.869 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.528 ' HE3' HG22 ' A' ' 22' ' ' THR . 63.6 tttm -64.35 -33.55 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.723 0.297 . . . . 71.14 111.183 -179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 84.0 m -54.54 -44.02 72.46 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.167 0.508 . . . . 73.24 110.944 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.2 pt -95.43 31.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 116.104 -0.498 . . . . 75.11 111.528 176.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 9.3 p30 48.71 22.18 0.5 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.916 1.286 . . . . 64.31 114.224 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -93.61 35.98 1.1 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.122 0.487 . . . . 73.15 110.81 173.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -54.9 -29.17 55.3 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.093 -0.503 . . . . 74.22 112.022 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.44 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 80.6 p -58.63 -41.57 86.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.789 0.328 . . . . 75.55 111.075 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.6 t -59.17 -26.37 64.72 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 112.268 0.47 . . . . 72.01 112.268 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.6 mt -54.3 -37.77 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.478 0.547 . . . . 74.35 112.478 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 44.4 mt-10 -71.71 -52.88 7.75 Favored Pre-proline 0 CA--C 1.548 0.873 0 N-CA-C 112.418 0.525 . . . . 75.02 112.418 -176.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HD2' ' O ' ' A' ' 116' ' ' SER . 12.0 Cg_endo -57.57 -30.01 87.04 Favored 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 121.629 1.553 . . . . 65.33 111.961 172.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.45 -44.55 86.9 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.906 -0.405 . . . . 70.24 109.906 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.7 -36.61 76.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.26 -0.427 . . . . 61.03 111.104 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.11 -43.7 98.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.574 -0.285 . . . . 54.15 110.655 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -60.86 -44.78 96.57 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 120.764 0.316 . . . . 43.31 111.415 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.9 mm -55.57 -52.43 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.448 0.642 . . . . 72.41 111.094 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.1 m -67.78 -34.9 77.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.387 -0.824 . . . . 71.15 111.604 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.501 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 10.2 t70 -62.95 -52.45 62.98 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.471 -0.331 . . . . 73.21 110.709 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.463 HG21 ' HB2' ' A' ' 81' ' ' MET . 90.0 t -58.21 -35.03 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.43 0.633 . . . . 75.13 111.002 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 22.4 tp -65.24 -53.57 42.43 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.724 -0.671 . . . . 62.01 111.205 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -77.99 -29.01 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 N-CA-C 112.414 0.524 . . . . 64.43 112.414 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 20.7 tpp180 -49.21 -40.3 33.04 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 112.564 0.579 . . . . 62.13 112.564 -174.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.669 HG23 ' HD3' ' A' ' 133' ' ' LYS . 1.3 t -130.64 -25.62 2.34 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.847 0.684 . . . . 64.43 112.847 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.669 ' HD3' HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -95.6 17.55 14.62 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.65 -0.656 . . . . 73.41 111.968 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -45.41 -55.96 5.51 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.994 0.426 . . . . 75.14 111.894 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 5.3 m-20 -66.96 -50.62 61.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.223 -0.444 . . . . 63.52 111.163 -178.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -52.53 -36.74 56.11 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 111.967 0.358 . . . . 75.25 111.967 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 28.9 mt -57.58 -53.12 61.73 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.033 0.383 . . . . 72.1 112.033 177.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.5 p -77.16 -41.95 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 111.911 0.337 . . . . 71.45 111.911 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 75.4 mmtt -57.26 -49.88 74.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.995 0.426 . . . . 71.12 111.712 -179.248 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -95.17 2.42 55.02 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.016 0.376 . . . . 71.13 112.016 -177.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 57.7 mtt85 55.59 58.25 4.68 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.943 0.401 . . . . 74.53 111.382 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.3 -57.58 4.25 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 115.097 0.799 . . . . 62.33 115.097 -172.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -66.95 -26.26 66.74 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.402 0.519 . . . . 73.52 112.402 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.18 -51.22 7.68 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.871 0.367 . . . . 74.14 111.222 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.94 88.6 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 116.359 -0.382 . . . . 72.51 113.196 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -53.59 -47.38 70.19 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.109 0.481 . . . . 73.03 111.887 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.29 -46.96 95.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 116.08 -0.509 . . . . 51.13 112.007 -178.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.36 -27.15 61.33 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.08 0.4 . . . . 75.42 112.08 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -56.71 -48.99 76.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.909 0.385 . . . . 72.01 111.443 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.32 -14.83 52.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.012 0.434 . . . . 72.41 111.25 174.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.452 ' HE1' ' HA ' ' A' ' 155' ' ' LEU . 44.9 t60 68.19 85.25 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.685 0.794 . . . . 54.43 112.07 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.411 HG13 ' NH1' ' A' ' 46' ' ' ARG . 64.7 t -124.02 -71.41 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 CA-C-N 115.793 -0.639 . . . . 72.14 111.247 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -106.81 67.71 0.72 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.075 0.464 . . . . 72.42 110.355 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -169.72 -167.06 0.63 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.859 -0.609 . . . . 61.45 111.122 -176.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.56 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -147.93 11.56 0.95 Allowed 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.299 -0.41 . . . . 74.13 111.725 175.833 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HG2' HD22 ' A' ' 155' ' ' LEU . 16.5 mm-40 -109.52 -11.92 14.75 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.341 0.497 . . . . 72.2 112.341 -175.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.31 99.58 0.25 Allowed Glycine 0 CA--C 1.527 0.843 0 C-N-CA 121.494 -0.384 . . . . 72.4 113.688 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -76.12 62.59 2.94 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.434 -0.412 . . . . 32.04 113.255 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.06 116.15 8.36 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.216 0.45 . . . . 73.11 112.216 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -112.28 -54.98 2.57 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.441 -0.345 . . . . 73.45 111.188 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -120.2 108.47 14.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.855 0.36 . . . . 74.31 111.253 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -87.63 130.01 34.92 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.929 0.395 . . . . 72.35 111.824 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -106.63 170.9 7.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.344 -0.389 . . . . 63.33 110.784 174.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 20.4 p80 . . . . . 0 C--O 1.258 1.519 0 N-CA-C 112.02 0.378 . . . . 74.22 112.02 178.667 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 ptm . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.26 0.553 . . . . 75.12 111.137 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -107.49 149.96 27.35 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.857 0.361 . . . . 71.54 111.943 -174.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -68.91 148.54 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.863 0.363 . . . . 63.23 111.045 172.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -59.09 -30.61 68.21 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.036 0.446 . . . . 74.14 110.535 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.427 HD22 ' HB ' ' A' ' 138' ' ' VAL . 58.5 tp -61.91 -43.52 98.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.105 -0.498 . . . . 72.54 110.859 173.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -63.19 -48.58 77.73 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.335 -0.393 . . . . 74.31 110.669 178.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -58.71 -39.35 80.54 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.943 0.349 . . . . 72.33 111.943 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.497 ' NE2' ' HB2' ' A' ' 33' ' ' SER . 7.9 tp60 -63.73 -52.39 60.69 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 74.12 111.02 176.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 m -59.43 -46.09 89.71 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.024 -0.534 . . . . 72.11 111.197 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.0 tp -61.75 -38.98 89.99 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.949 -0.568 . . . . 73.44 111.476 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.44 -51.25 70.19 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.329 0.585 . . . . 65.24 110.892 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.5 mt -61.45 -54.32 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.542 -0.754 . . . . 72.22 111.597 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.409 HD13 HG22 ' A' ' 125' ' ' ILE . 75.1 mt -64.13 -46.28 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 116.031 -0.531 . . . . 71.13 112.097 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -56.99 -52.12 66.53 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.768 0.318 . . . . 74.43 111.727 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 15' ' ' ARG . 48.5 mtt180 -66.19 -32.61 74.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.727 0.269 . . . . 73.4 111.727 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -62.63 -54.66 36.24 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 122.101 -0.375 . . . . 75.54 110.849 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -55.66 -45.01 77.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.699 0.285 . . . . 74.11 111.343 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -62.64 -63.35 1.25 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.478 0.547 . . . . 71.31 112.478 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 65.2 mm-40 -58.25 -34.86 70.93 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 112.649 0.611 . . . . 74.2 112.649 -174.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -80.33 -27.55 38.36 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.9 -0.5 . . . . 71.35 111.913 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.5 -33.75 69.52 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.151 0.501 . . . . 61.44 110.874 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.8 p -87.31 -30.31 20.94 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.021 -0.536 . . . . 61.24 111.418 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.98 19.59 46.44 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 121.302 -0.475 . . . . 61.14 112.644 -178.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -98.92 -167.14 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.424 0.631 . . . . 74.33 112.337 -177.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -148.06 146.1 28.72 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 75.24 110.799 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -105.58 159.87 15.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.313 0.578 . . . . 75.0 111.8 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.5 t -147.27 37.59 0.94 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.643 0.735 . . . . 53.43 110.577 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.439 ' HB3' ' HD2' ' A' ' 29' ' ' PRO . 64.0 mttm -128.23 165.02 33.68 Favored Pre-proline 0 N--CA 1.472 0.673 0 CA-C-N 115.849 -0.614 . . . . 55.24 111.701 -173.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.439 ' HD2' ' HB3' ' A' ' 28' ' ' LYS . 61.8 Cg_endo -75.16 148.46 34.69 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.324 2.016 . . . . 64.35 111.582 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.533 ' SD ' HD22 ' A' ' 41' ' ' LEU . 77.0 mtp -126.09 133.37 51.68 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.303 0.853 . . . . 74.31 113.303 -171.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 58.57 -150.69 34.15 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 114.941 0.736 . . . . 74.3 114.941 172.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -79.77 -53.39 6.84 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.913 0.387 . . . . 75.24 110.9 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.497 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 14.6 m -91.22 87.66 6.6 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.887 0.375 . . . . 70.3 110.238 175.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -53.91 -58.82 11.18 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 115.792 -0.64 . . . . 74.14 114.052 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.609 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -58.6 -51.4 70.05 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.879 0.325 . . . . 63.42 111.879 -177.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.9 m -57.86 -38.79 76.33 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.825 0.345 . . . . 62.41 111.604 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.407 ' HB3' ' HB2' ' A' ' 30' ' ' MET . 23.0 t -65.12 -51.33 61.93 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.448 -0.342 . . . . 52.11 111.319 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -58.67 -45.97 88.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.576 -0.284 . . . . 72.43 111.592 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.609 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 18.1 mtpp -56.08 -48.32 76.32 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.936 0.398 . . . . 74.12 110.969 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.94 -43.65 98.41 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.36 -0.382 . . . . 63.52 111.447 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.533 HD22 ' SD ' ' A' ' 30' ' ' MET . 55.9 tp -59.42 -53.32 59.57 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.158 0.429 . . . . 75.41 112.158 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.91 -31.47 71.27 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.234 -0.291 . . . . 33.03 111.655 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.566 HG23 HG21 ' A' ' 152' ' ' VAL . 98.6 m -64.89 -43.01 94.3 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.814 0.34 . . . . 71.02 110.266 173.254 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.1 mt -54.12 -39.03 66.07 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.389 -0.369 . . . . 71.11 111.185 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -67.96 -45.8 73.2 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.765 0.317 . . . . 72.32 111.626 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.1 ttm-85 -61.0 -45.29 95.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.376 0.51 . . . . 71.11 112.376 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.412 ' O ' HG23 ' A' ' 51' ' ' VAL . 31.3 m -87.52 -33.74 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.073 0.463 . . . . 72.33 111.321 178.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 51' ' ' VAL . . . -69.44 -23.58 76.43 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.298 -0.477 . . . . 63.44 113.634 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.64 -53.78 34.99 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 117.183 0.492 . . . . 60.32 110.911 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.29 -44.38 28.51 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.061 -0.518 . . . . 62.04 113.017 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 47' ' ' VAL . 76.8 t -57.29 -46.06 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 112.527 0.565 . . . . 73.33 112.527 -176.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -57.31 -44.2 83.95 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 122.11 -0.369 . . . . 73.34 111.274 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -67.42 -54.11 23.21 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.47 0.545 . . . . 74.4 112.47 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -70.58 -20.06 62.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.208 0.447 . . . . 74.41 112.208 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 66.7 m80 -90.3 -26.23 20.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.269 -0.269 . . . . 64.14 111.468 171.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.599 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 35.4 tt0 -53.08 -55.43 23.96 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.87 0.367 . . . . 70.24 111.518 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -56.4 -28.18 58.56 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.225 -0.443 . . . . 62.32 111.902 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.5 -44.63 20.86 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.904 0.383 . . . . 72.02 111.556 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.553 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.8 m-85 -70.8 -22.82 62.31 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.822 0.305 . . . . 65.35 111.822 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.448 ' NE2' ' HZ ' ' A' ' 104' ' ' PHE . 69.9 mm-40 -49.29 -35.88 19.28 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.966 0.412 . . . . 75.52 111.38 174.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.23 -30.43 70.83 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 121.267 -0.492 . . . . 60.42 112.988 177.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 72.8 mtm -89.11 -47.35 8.16 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.463 -0.433 . . . . 70.02 111.696 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.543 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 9.7 mp -56.85 -34.04 67.41 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.981 -0.449 . . . . 75.0 112.168 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -63.3 -17.42 62.52 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 120.831 0.348 . . . . 73.14 111.808 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -113.92 1.67 14.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.718 0.294 . . . . 72.42 111.145 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 63' ' ' LEU . 91.2 mt -102.94 -73.97 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.516 0.327 . . . . 64.04 111.286 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 40.95 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.79 -0.641 . . . . 72.53 112.065 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.504 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.7 mp -59.6 104.99 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.715 -0.675 . . . . 64.32 112.161 -173.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.54 -4.99 15.21 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.757 -0.656 . . . . 52.24 112.173 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -159.04 169.57 23.99 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.02 0.438 . . . . 43.03 111.798 173.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.67 -36.72 69.91 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.732 0.641 . . . . 73.41 112.732 -175.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -55.19 -35.05 64.41 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 111.689 0.255 . . . . 74.45 111.689 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.497 ' HB3' HG13 ' A' ' 68' ' ' ILE . 67.6 m-20 -62.56 -42.69 99.7 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.904 0.383 . . . . 71.23 110.81 176.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.9 t -60.81 -43.05 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.171 0.51 . . . . 74.23 110.637 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -65.78 -29.47 69.97 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.227 -0.442 . . . . 74.31 111.112 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.5 m -68.42 -37.71 80.56 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.83 0.348 . . . . 75.15 110.586 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.519 ' O ' ' HG2' ' A' ' 81' ' ' MET . 98.5 mt -58.45 -33.14 69.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.36 -0.382 . . . . 64.43 111.194 175.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -52.27 -41.4 62.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.857 0.36 . . . . 71.42 111.591 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.62 -37.47 84.08 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.396 -0.366 . . . . 72.15 111.614 178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.61 -41.65 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.976 0.417 . . . . 45.43 110.942 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.3 mmt -55.02 -42.75 72.99 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.016 -0.538 . . . . 54.43 111.487 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 82.0 mt -58.54 -40.96 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.201 -0.454 . . . . 72.51 111.237 175.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -67.98 -26.83 66.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.18 0.437 . . . . 74.41 112.18 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.526 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 62.1 t -56.7 -25.37 21.39 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.149 0.499 . . . . 61.13 110.993 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.3 m-85 -92.56 5.0 52.48 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.808 0.67 . . . . 70.52 112.808 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.3 m -54.55 -34.14 61.33 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 112.118 0.414 . . . . 62.22 112.118 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.497 ' HB2' ' HD2' ' A' ' 94' ' ' ARG . 3.7 m-20 -78.7 -53.63 6.94 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.75 0.31 . . . . 73.34 111.317 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 58.64 61.88 6.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 116.445 -0.343 . . . . 73.34 113.686 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 m -100.54 149.58 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 112.6 0.593 . . . . 71.43 112.6 -176.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 32.3 p -66.32 -7.03 16.25 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.901 0.704 . . . . 70.0 112.901 -178.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -73.29 -15.75 61.4 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.953 0.353 . . . . 70.04 111.953 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.539 ' HE3' HG13 ' A' ' 95' ' ' ILE . 93.4 m95 64.52 3.16 1.81 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 122.823 0.449 . . . . 73.53 112.147 -176.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.42 -24.83 56.87 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.461 -0.4 . . . . 50.54 113.296 177.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.568 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 2.8 mmp_? -67.26 -33.04 74.47 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.462 -0.434 . . . . 75.54 111.255 176.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.539 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.1 mm -63.8 -46.11 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.303 0.573 . . . . 62.21 109.669 173.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -57.59 -44.43 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.704 -0.68 . . . . 64.44 110.904 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.0 m -61.57 -44.85 96.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.324 -0.398 . . . . 72.31 111.259 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.586 ' HG ' HG23 ' A' ' 125' ' ' ILE . 41.9 tp -58.49 -54.92 41.65 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.236 0.541 . . . . 71.11 111.209 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.2 mt -65.65 -32.58 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 115.98 -0.555 . . . . 74.22 111.221 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -64.36 -48.46 75.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 116.503 -0.317 . . . . 75.33 111.449 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 105' ' ' VAL . 14.3 t80 -61.39 -43.13 99.39 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.84 0.353 . . . . 74.33 110.582 177.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.73 -44.51 95.74 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 120.932 -0.652 . . . . 73.45 112.481 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.36 94.22 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.689 0.28 . . . . 44.25 111.484 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 16.0 t80 -64.83 -45.53 85.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.805 0.336 . . . . 74.32 111.429 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.557 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.7 t -64.42 -37.94 81.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 121.973 -0.454 . . . . 74.14 110.023 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . 0.403 ' HA ' HD12 ' A' ' 109' ' ' LEU . . . -61.15 -50.69 72.16 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.338 0.496 . . . . 74.34 112.338 179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.69 -35.59 76.67 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.15 -0.344 . . . . 73.1 111.004 178.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.432 ' O ' HG12 ' A' ' 112' ' ' ILE . 86.6 t60 -68.05 -35.28 77.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.751 0.31 . . . . 70.52 110.627 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 85.7 mt -60.77 -49.47 77.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.654 -0.248 . . . . 73.12 111.057 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -62.79 -38.19 89.68 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.789 0.328 . . . . 71.43 110.93 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 99.6 m -53.6 -38.33 63.88 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.126 0.489 . . . . 73.02 111.084 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -103.59 19.5 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 116.361 -0.382 . . . . 72.41 111.921 177.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 57.03 59.17 3.57 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.324 0.583 . . . . 70.24 112.396 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -131.17 33.89 4.08 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.915 -0.584 . . . . 74.21 110.984 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.77 -33.23 66.41 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.518 0.562 . . . . 74.31 112.518 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.0 m -54.98 -27.28 42.78 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 120.791 0.329 . . . . 74.51 111.606 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.0 t -79.18 -27.18 42.61 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.022 0.379 . . . . 42.4 112.022 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.64 -45.14 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 112.807 0.669 . . . . 65.03 112.807 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.76 -53.32 44.44 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 112.712 0.634 . . . . 65.42 112.712 -176.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.34 -27.23 82.74 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 121.598 1.532 . . . . 61.51 112.216 174.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -66.08 -44.43 84.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.362 -0.607 . . . . 74.43 109.362 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.11 -37.85 81.24 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.134 -0.485 . . . . 60.51 110.842 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.85 -40.03 93.91 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.221 -0.445 . . . . 64.45 110.79 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 61.6 m -62.96 -45.42 92.51 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.787 0.327 . . . . 73.2 111.246 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.586 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.7 -52.31 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 121.5 0.667 . . . . 74.35 110.669 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.404 ' OG1' HD12 ' A' ' 13' ' ' ILE . 25.4 m -68.24 -33.46 74.43 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.225 -0.898 . . . . 61.44 111.582 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 31.1 t70 -65.05 -51.97 58.47 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.744 -0.207 . . . . 75.42 111.282 -176.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 89.3 t -59.8 -41.92 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.275 0.56 . . . . 63.4 110.549 176.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 55.0 tp -55.97 -53.34 58.13 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.51 -0.768 . . . . 60.24 111.611 176.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 68.8 t -75.25 -26.52 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 115.902 -0.59 . . . . 73.53 111.843 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 18.7 tpt180 -57.31 -37.32 72.31 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.005 0.372 . . . . 72.53 112.005 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.595 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.7 t -125.07 -38.68 2.3 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.82 0.674 . . . . 63.13 112.82 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.595 ' HG2' HG23 ' A' ' 132' ' ' THR . 33.0 mmtp -105.04 20.01 19.61 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.767 0.654 . . . . 53.34 112.767 -173.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 46.6 ttp180 -54.68 -54.27 43.96 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.232 0.539 . . . . 65.12 111.365 176.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -53.25 -44.81 68.43 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.533 -0.758 . . . . 72.41 111.659 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -62.38 -38.22 88.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 111.776 0.287 . . . . 72.11 111.776 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.9 mt -56.44 -50.07 72.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.614 0.245 . . . . 72.43 111.605 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.427 ' HB ' HD22 ' A' ' 5' ' ' LEU . 8.1 p -77.19 -43.46 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 112.101 0.408 . . . . 62.41 112.101 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -62.36 -60.34 3.69 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.962 0.411 . . . . 71.12 111.808 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -81.97 -2.99 53.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.606 -0.27 . . . . 72.3 111.648 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 70.9 mtt180 57.14 61.76 2.45 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.181 -0.463 . . . . 71.24 110.836 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -51.21 -45.1 52.29 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.703 -0.68 . . . . 74.01 114.635 -173.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -72.85 -23.81 60.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.363 0.581 . . . . 74.12 111.786 -176.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -81.74 -47.37 13.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.301 0.572 . . . . 75.12 110.215 173.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.425 ' HA2' ' CG ' ' A' ' 148' ' ' GLU . . . -62.84 -30.71 77.99 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.778 -0.646 . . . . 15.31 113.369 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -58.76 -40.56 84.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.997 0.427 . . . . 64.14 111.58 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 48.6 t -73.57 -41.75 55.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.307 -0.406 . . . . 74.11 112.056 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.446 ' HB2' ' HB2' ' A' ' 160' ' ' HIS . 0.0 OUTLIER -73.39 -31.63 64.0 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.714 0.635 . . . . 61.22 112.714 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.04 -48.72 80.57 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.036 0.446 . . . . 70.54 111.487 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -83.8 -15.08 49.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.324 -0.398 . . . . 73.05 111.387 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 76.3 t60 55.77 68.24 0.89 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.593 0.711 . . . . 64.45 111.114 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.566 HG21 HG23 ' A' ' 43' ' ' THR . 69.5 t -102.41 -60.21 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 115.632 -0.713 . . . . 71.32 112.631 -175.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -132.22 17.97 4.49 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.066 0.46 . . . . 73.5 111.12 -174.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -78.77 158.1 28.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.339 0.59 . . . . 74.2 111.939 -177.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.512 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -89.73 2.3 55.01 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.817 -0.629 . . . . 54.52 112.31 -177.439 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 63.07 84.31 0.15 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 121.076 0.465 . . . . 73.32 111.835 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -176.79 -151.9 9.36 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 120.586 -0.816 . . . . 74.24 113.52 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.7 -120.74 15.28 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.562 -0.351 . . . . 71.42 112.944 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -141.49 55.02 1.52 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.28 0.562 . . . . 74.44 110.086 173.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 148' ' ' GLU . 5.1 p80 -54.98 124.55 17.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.416 -0.811 . . . . 64.23 111.984 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -74.77 -54.42 7.37 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.717 -0.219 . . . . 62.12 111.432 -176.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 53.92 0.56 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.684 0.994 . . . . 55.23 113.684 -179.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -84.49 159.69 20.69 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.665 -0.647 . . . . 73.22 111.261 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 17.9 m80 . . . . . 0 C--O 1.255 1.383 0 CA-C-O 119.177 -0.44 . . . . 64.32 111.46 -179.714 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.124 0.487 . . . . 64.44 110.931 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -141.67 123.85 15.56 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.912 -0.586 . . . . 72.33 111.031 -177.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -79.3 178.73 7.86 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.999 0.428 . . . . 62.44 111.959 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -63.69 -45.55 89.55 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.492 -0.322 . . . . 70.54 111.839 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.1 tp -61.02 -39.9 91.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.022 0.439 . . . . 75.41 111.146 -178.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -59.25 -47.91 83.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.202 -0.454 . . . . 75.23 110.951 174.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -44.36 94.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 111.939 0.348 . . . . 72.02 111.939 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -56.57 -52.44 64.8 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.256 0.551 . . . . 73.33 110.736 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.9 m -61.85 -43.78 98.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.775 -0.648 . . . . 75.13 111.261 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.1 -46.71 85.07 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.284 -0.416 . . . . 75.35 111.544 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -58.07 -51.17 70.79 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.935 0.398 . . . . 73.42 111.151 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.5 mt -58.62 -50.67 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.004 0.43 . . . . 74.1 111.672 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.464 HD13 HG22 ' A' ' 125' ' ' ILE . 84.7 mt -65.94 -48.77 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.217 -0.447 . . . . 63.24 111.818 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -55.34 -46.61 76.39 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.891 0.377 . . . . 71.35 110.845 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.611 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 3.3 mtt85 -53.86 -57.07 12.29 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.15 -0.477 . . . . 73.51 111.285 174.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -53.84 -45.33 70.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.394 0.516 . . . . 72.3 112.394 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.23 -45.77 87.1 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.826 0.346 . . . . 75.41 111.292 177.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.7 mmm180 -61.49 -48.34 81.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.894 0.378 . . . . 74.33 111.296 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 18.6 mm-40 -56.15 -51.63 67.29 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.129 0.49 . . . . 74.5 111.803 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.5 tp60 -70.92 -36.25 72.59 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.161 -0.472 . . . . 73.22 112.094 -176.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.5 72.83 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.043 0.386 . . . . 60.2 112.043 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.5 p -95.2 -17.06 22.06 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.338 0.496 . . . . 74.33 112.338 -178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.95 48.12 12.27 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.228 -0.511 . . . . 60.3 113.236 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -129.88 174.23 9.93 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.345 0.498 . . . . 64.12 112.345 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.529 ' HA ' ' NH1' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -129.64 145.62 51.49 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.068 -0.515 . . . . 64.22 110.761 176.284 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -88.33 152.2 22.09 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.66 0.615 . . . . 74.34 112.66 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.9 t -144.28 -5.8 0.75 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.53 -0.759 . . . . 74.23 112.007 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HE2' ' HB2' ' A' ' 28' ' ' LYS . 3.3 mppt? -81.14 153.02 71.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-O 120.699 0.285 . . . . 73.51 111.282 -177.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.25 131.53 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.347 2.032 . . . . 63.41 112.34 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 55.5 tpp -60.41 149.23 34.64 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 121.163 0.506 . . . . 65.4 111.818 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.63 4.7 67.73 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.279 0.871 . . . . 42.52 115.279 -173.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -155.64 -76.64 0.1 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.128 0.964 . . . . 71.21 112.003 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -95.01 136.54 35.2 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.453 -0.154 . . . . 72.21 110.864 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.36 -93.27 0.5 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 121.113 -0.565 . . . . 62.45 114.265 -177.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.9 -49.66 72.8 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.635 0.976 . . . . 63.31 113.635 -172.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.5 m -56.33 -46.23 80.02 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.949 0.351 . . . . 75.14 111.949 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.2 p -63.67 -44.43 93.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.892 0.377 . . . . 73.24 111.302 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.8 mtp180 -63.67 -54.04 41.9 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.1 0.408 . . . . 75.42 112.1 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 0.2 OUTLIER -56.75 -37.93 71.72 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.814 0.34 . . . . 71.44 110.879 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.29 72.98 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.857 0.361 . . . . 73.13 111.445 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.414 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 44.2 tp -63.96 -44.93 91.28 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.423 -0.353 . . . . 65.42 111.828 -178.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.25 -34.49 78.12 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 122.181 -0.324 . . . . 74.3 110.677 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.575 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.7 m -61.22 -46.58 89.85 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.738 0.304 . . . . 51.13 110.385 172.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -53.99 -31.64 51.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.441 -0.345 . . . . 72.43 111.673 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.529 ' NH1' ' HA ' ' A' ' 25' ' ' LYS . 65.3 mtt-85 -72.64 -54.88 7.84 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 122.031 -0.418 . . . . 74.11 111.272 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.434 ' NH1' HG13 ' A' ' 152' ' ' VAL . 15.8 ptm180 -63.69 -43.87 95.36 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.502 0.556 . . . . 75.41 112.502 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.575 HG22 ' O ' ' A' ' 43' ' ' THR . 10.7 m -87.23 -33.63 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 122.119 -0.363 . . . . 72.53 111.824 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.42 -48.33 58.22 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 120.831 -0.7 . . . . 72.42 112.808 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.0 t70 -57.27 -52.28 65.95 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.912 0.387 . . . . 71.31 110.719 176.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.21 -52.1 46.26 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 121.189 -0.529 . . . . 54.22 112.857 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.443 HG21 HG11 ' A' ' 96' ' ' VAL . 63.4 t -58.04 -43.43 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 111.726 0.269 . . . . 73.13 111.726 178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.541 ' NE2' ' HE3' ' A' ' 107' ' ' LYS . 50.0 mt-30 -55.73 -45.77 77.91 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.65 0.262 . . . . 60.54 111.52 177.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 53.2 mtp85 -66.81 -37.73 85.1 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.729 0.64 . . . . 74.02 112.729 -173.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.87 -22.15 27.67 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.592 -0.693 . . . . 73.25 112.142 177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.412 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 0.6 OUTLIER -86.43 -21.87 26.86 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.161 -0.337 . . . . 63.33 111.775 175.18 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.92 -48.46 60.69 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.414 0.524 . . . . 72.33 112.414 -176.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.7 t -56.3 -28.4 58.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.135 0.493 . . . . 75.41 112.079 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.57 -38.32 23.85 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.948 0.404 . . . . 61.31 111.718 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 18.3 m-85 -76.23 -33.16 59.21 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.624 0.601 . . . . 71.52 112.624 -176.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 63.5 mm-40 -46.29 -56.52 5.67 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.603 0.594 . . . . 72.22 112.603 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.99 -22.65 58.12 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 121.367 -0.444 . . . . 44.42 114.139 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.556 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 26.4 mtm -87.4 -36.54 17.7 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 122.032 -0.687 . . . . 72.24 109.44 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.3 tp -60.1 -33.1 71.65 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.522 -0.763 . . . . 62.41 110.953 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 54.3 mtt85 -65.47 -42.78 91.89 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.741 -0.663 . . . . 74.42 112.056 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -77.1 -15.64 59.49 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.786 0.326 . . . . 75.1 110.781 177.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 62' ' ' MET . 95.8 mt -81.95 -80.82 0.15 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.342 -0.39 . . . . 61.24 111.27 175.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.2 t70 45.24 90.44 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.34 0.656 . . . . 61.23 111.647 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.536 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.8 mp -68.55 102.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.244 0.545 . . . . 55.54 111.619 -175.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -12.03 27.81 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.128 -0.487 . . . . 70.35 111.892 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 23.6 p-10 -163.0 175.16 11.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.043 0.449 . . . . 63.34 112.02 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -50.83 -36.99 40.31 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.881 -0.6 . . . . 70.55 112.494 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.544 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 37.7 t70 -56.87 -39.71 74.85 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 111.879 0.325 . . . . 73.24 111.879 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.529 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.0 m-20 -63.18 -36.07 82.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.883 0.373 . . . . 65.13 110.814 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.13 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.075 0.464 . . . . 65.3 110.511 175.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 9.6 mtmp? -63.96 -29.94 71.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.009 0.433 . . . . 75.31 110.821 175.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -67.57 -40.47 84.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.016 0.436 . . . . 64.32 110.618 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.1 mt -58.78 -34.73 71.77 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.402 -0.363 . . . . 71.24 111.211 176.335 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 47.0 m -52.16 -37.75 55.52 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.941 0.4 . . . . 65.22 110.945 176.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.499 ' HD3' HD12 ' A' ' 82' ' ' ILE . 31.0 mmt180 -64.07 -48.87 74.54 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.315 -0.402 . . . . 75.31 111.399 175.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 84' ' ' VAL . 86.8 t -55.29 -40.99 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.116 0.484 . . . . 61.14 110.489 175.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.522 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.2 mmt -60.79 -38.57 85.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.85 -0.614 . . . . 72.2 111.436 177.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.499 HD12 ' HD3' ' A' ' 79' ' ' ARG . 85.5 mt -61.32 -38.36 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-O 121.027 0.442 . . . . 72.55 110.623 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -68.8 -28.8 67.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.383 -0.371 . . . . 74.31 111.47 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 80' ' ' VAL . 95.1 t -61.37 -34.48 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.919 0.39 . . . . 75.33 111.183 174.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.517 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 22.8 m-85 -96.57 15.95 20.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.012 0.375 . . . . 75.32 112.012 176.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.4 t -69.44 -30.49 68.43 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.127 0.489 . . . . 51.31 110.511 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.68 104.83 2.09 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.871 -0.604 . . . . 71.23 111.012 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.74 67.33 1.99 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 121.331 -0.462 . . . . 74.24 112.896 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 18.8 t -132.28 141.4 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-O 120.856 0.36 . . . . 72.55 111.103 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -77.5 4.95 9.89 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.937 0.717 . . . . 54.2 112.937 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -73.65 116.95 14.84 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.085 0.469 . . . . 75.14 111.689 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.535 ' HE3' HG13 ' A' ' 95' ' ' ILE . 95.9 m95 -60.15 -10.66 4.68 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 112.761 0.652 . . . . 74.14 112.761 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.05 -25.06 53.08 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 121.228 -0.51 . . . . 60.21 112.86 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -70.57 -35.58 73.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.519 -0.401 . . . . 71.51 111.046 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.535 HG13 ' HE3' ' A' ' 92' ' ' TRP . 45.3 mm -62.73 -45.31 99.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.31 0.576 . . . . 72.41 110.037 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.443 HG11 HG21 ' A' ' 51' ' ' VAL . 43.5 t -56.02 -47.4 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 115.657 -0.702 . . . . 63.33 110.75 174.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 94.3 m -55.13 -44.14 74.79 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.537 -0.301 . . . . 54.21 111.517 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 125' ' ' ILE . 22.2 tp -58.46 -55.67 32.07 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.396 0.617 . . . . 65.31 111.648 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 55.8 mt -71.09 -32.56 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.784 -0.644 . . . . 64.53 111.317 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.4 t -61.6 -52.05 66.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.892 -0.594 . . . . 74.43 111.244 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.497 ' O ' HG23 ' A' ' 105' ' ' VAL . 23.4 t80 -63.95 -35.99 82.48 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.692 0.282 . . . . 75.21 110.87 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.08 -48.67 84.95 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 120.985 -0.626 . . . . 72.01 112.574 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.46 83.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.859 0.361 . . . . 74.51 111.348 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.471 ' CE2' HD22 ' A' ' 63' ' ' LEU . 78.3 t80 -60.72 -46.65 89.59 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.387 -0.369 . . . . 74.11 111.232 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 101' ' ' PHE . 58.0 t -64.88 -37.33 79.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 120.908 0.385 . . . . 74.12 110.512 175.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.73 -39.22 70.83 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.112 -0.495 . . . . 75.25 111.496 176.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.541 ' HE3' ' NE2' ' A' ' 52' ' ' GLN . 94.9 mttt -56.08 -49.27 74.26 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.359 0.6 . . . . 72.32 110.653 174.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.524 ' O ' HG12 ' A' ' 112' ' ' ILE . 58.3 t60 -63.35 -41.9 98.89 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.725 -0.671 . . . . 73.33 111.016 -179.15 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.536 HD21 ' HB ' ' A' ' 68' ' ' ILE . 88.5 mt -63.11 -49.96 72.4 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.062 0.458 . . . . 75.51 111.451 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -59.67 -30.26 68.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.667 -0.697 . . . . 75.53 110.63 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.5 m -77.31 -48.75 16.58 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.008 -0.542 . . . . 70.53 112.246 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 108' ' ' HIS . 42.2 pt -83.79 24.32 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 112.681 0.623 . . . . 73.33 112.681 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 62.4 18.09 10.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.549 0.574 . . . . 61.14 112.549 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -102.88 31.41 4.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.24 0.543 . . . . 62.51 110.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.26 -33.58 67.75 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.675 -0.693 . . . . 52.2 112.386 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 62.3 m -56.34 -32.75 64.98 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 120.886 0.374 . . . . 61.4 111.772 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.461 ' HB2' HD13 ' A' ' 109' ' ' LEU . 48.2 m -62.29 -26.76 68.59 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.223 0.453 . . . . 65.42 112.223 -179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.27 -44.22 74.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.849 0.685 . . . . 53.31 112.849 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -64.04 -53.76 45.66 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 112.52 0.563 . . . . 63.5 112.52 -175.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.34 -28.05 71.77 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.833 1.689 . . . . 73.35 112.276 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.2 tt -61.86 -40.68 96.22 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.99 0.424 . . . . 72.23 109.994 175.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.76 -33.83 73.53 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.239 -0.437 . . . . 75.13 111.233 175.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.344 -0.389 . . . . 63.12 110.908 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.8 m -59.01 -45.33 90.96 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.956 0.408 . . . . 33.32 111.276 175.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.549 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.5 mm -57.27 -53.17 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.213 0.53 . . . . 65.21 111.09 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 36.7 m -65.55 -38.52 89.83 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.798 -0.637 . . . . 61.05 111.91 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 29.5 t70 -59.39 -51.83 68.22 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.602 0.239 . . . . 62.12 111.226 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.522 HG21 ' HB2' ' A' ' 81' ' ' MET . 67.8 t -63.9 -39.62 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.928 0.394 . . . . 71.11 111.086 178.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.443 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -55.63 -52.47 63.7 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.324 0.583 . . . . 73.0 110.902 176.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 95.0 t -72.76 -30.44 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.806 -0.633 . . . . 71.31 111.633 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 2.0 tpt180 -57.36 -30.26 64.7 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.116 0.413 . . . . 74.11 112.116 -175.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.638 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.1 OUTLIER -130.18 -30.78 1.93 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.451 0.908 . . . . 72.23 113.451 -176.887 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.638 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.4 mptp? -112.36 23.83 13.2 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.425 -0.797 . . . . 73.33 113.007 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 16.2 ttp180 -53.85 -65.39 0.58 Allowed 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.666 0.746 . . . . 52.4 112.187 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.93 -31.6 71.94 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.154 -0.93 . . . . 61.42 111.097 -173.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -68.6 -35.82 77.87 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.404 -0.362 . . . . 62.55 111.621 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.56 ' HB2' HD21 ' A' ' 5' ' ' LEU . 52.6 mt -54.64 -45.6 73.82 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 120.555 0.217 . . . . 72.24 111.534 175.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.3 p -78.88 -43.78 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 112.329 0.492 . . . . 51.12 112.329 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -60.87 -57.76 11.29 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.128 0.489 . . . . 73.24 112.167 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -87.61 1.41 53.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.5 -0.318 . . . . 71.44 111.514 -177.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 58.15 62.2 2.1 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.306 -0.406 . . . . 72.14 110.507 -178.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 146' ' ' PHE . . . -42.85 -52.56 5.58 Favored Glycine 0 C--O 1.223 -0.545 0 CA-C-N 115.689 -0.687 . . . . 74.15 114.319 -174.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -72.04 -21.06 61.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.439 0.533 . . . . 74.0 112.439 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -84.82 -58.22 2.8 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.1 0.476 . . . . 71.34 110.66 174.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.573 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -56.84 -32.04 61.65 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 115.978 -0.555 . . . . 61.3 113.112 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 142' ' ' GLY . 80.3 t80 -54.88 -39.26 68.51 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.317 0.58 . . . . 63.35 111.14 174.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.544 HG21 ' HG3' ' A' ' 39' ' ' LYS . 96.2 t -73.51 -43.2 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 115.721 -0.672 . . . . 74.0 112.263 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.573 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 10.0 pt-20 -73.31 -33.75 65.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 111.934 0.346 . . . . 53.12 111.934 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -56.66 -48.2 78.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.1 0.476 . . . . 73.13 111.232 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.49 -5.35 59.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 72.35 111.688 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 60.74 50.44 5.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.546 0.689 . . . . 74.44 111.917 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.465 HG21 ' OG1' ' A' ' 43' ' ' THR . 97.4 t -68.77 -29.13 42.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.468 -0.787 . . . . 74.23 112.171 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.01 7.88 4.72 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.979 0.419 . . . . 73.12 111.186 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -103.0 120.66 41.04 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.154 -0.475 . . . . 72.33 112.183 -171.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.401 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -67.91 -21.98 65.1 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.259 0.552 . . . . 42.05 110.665 172.129 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -81.39 57.34 3.22 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.939 -0.573 . . . . 71.52 111.115 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 149.26 136.26 2.61 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 121.028 -0.605 . . . . 75.52 113.505 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -97.06 -144.74 17.82 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 121.406 -0.426 . . . . 74.12 113.039 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -90.13 115.47 27.4 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.04 0.448 . . . . 72.24 111.718 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.25 -57.34 10.76 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.873 -0.603 . . . . 62.24 111.753 -178.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.11 145.18 17.92 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.484 -0.325 . . . . 72.33 110.593 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 14.6 p80 -149.51 -177.89 6.12 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.749 0.309 . . . . 73.31 111.074 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -82.94 115.46 21.8 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.591 -0.277 . . . . 60.34 110.865 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.5 p80 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.862 -0.59 . . . . 74.44 111.341 177.836 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ptt? . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 111.961 0.356 . . . . 75.25 111.961 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.97 156.58 20.41 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.161 0.505 . . . . 62.5 112.236 -175.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' A' ' 6' ' ' TYR . 19.4 t70 -54.98 149.78 11.26 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.951 -0.568 . . . . 70.35 111.287 174.007 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.455 ' HG2' ' NH1' ' A' ' 32' ' ' ARG . 30.1 tt0 -56.71 -46.03 81.49 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.242 0.544 . . . . 74.41 111.496 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 137' ' ' LEU . 59.8 tp -68.96 -33.5 73.8 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.218 -0.447 . . . . 62.45 110.69 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.411 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 6.6 t80 -59.88 -47.19 86.78 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.246 -0.434 . . . . 64.41 109.954 174.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -57.04 -49.64 75.21 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.965 0.358 . . . . 73.03 111.965 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 60.6 tt0 -62.53 -48.17 80.72 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.426 0.631 . . . . 63.1 111.475 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 m -59.86 -32.09 70.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.117 0.484 . . . . 54.2 110.751 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -72.75 -46.22 54.55 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.131 -0.486 . . . . 73.34 111.865 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 8' ' ' GLN . 14.1 pt-20 -57.59 -43.07 84.33 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.965 0.412 . . . . 63.24 110.765 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 67.1 mt -65.15 -54.7 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 116.053 -0.521 . . . . 61.22 111.895 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 125' ' ' ILE . 76.5 mt -66.4 -51.16 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.836 0.35 . . . . 72.13 111.857 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.511 ' HA ' ' HB1' ' A' ' 122' ' ' ALA . 47.7 t -50.04 -51.27 43.55 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.229 -0.441 . . . . 72.42 111.559 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 28.0 mtp180 -58.75 -45.99 88.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 120.853 -0.339 . . . . 74.1 111.517 176.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -53.43 -44.18 68.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.882 0.327 . . . . 64.35 111.882 -176.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -62.22 -42.65 99.5 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.815 -0.175 . . . . 63.42 111.348 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.554 ' NH2' ' HG2' ' A' ' 119' ' ' GLU . 8.4 mpt_? -61.55 -48.26 81.79 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.689 0.28 . . . . 63.11 111.34 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 16.1 mm-40 -54.45 -46.81 73.36 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.415 0.626 . . . . 65.32 111.062 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.688 ' HG3' ' HE2' ' A' ' 107' ' ' LYS . 8.6 tp-100 -75.64 -43.05 49.75 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.761 -0.654 . . . . 73.33 112.369 -175.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.27 80.38 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.251 0.463 . . . . 61.43 112.251 -177.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.8 p -87.02 -28.62 22.51 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.799 0.333 . . . . 55.4 111.644 -177.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.88 6.27 88.56 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.213 -0.517 . . . . 72.11 112.875 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.79 115.19 23.37 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.9 0.381 . . . . 72.51 111.443 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -74.83 128.76 36.35 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.296 -0.411 . . . . 73.31 111.025 177.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.94 153.34 20.92 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.383 0.611 . . . . 72.43 111.898 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 t -94.32 1.48 55.9 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.005 -0.543 . . . . 73.51 112.253 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 96.8 mttt -51.16 137.99 27.21 Favored Pre-proline 0 N--CA 1.477 0.875 0 N-CA-C 112.213 0.449 . . . . 74.01 112.213 177.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 28' ' ' LYS . 17.5 Cg_exo -66.33 72.76 0.39 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.27 2.647 . . . . 62.51 113.709 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.6 mmm 37.44 -89.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.89 1.07 . . . . 75.0 113.89 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -173.0 -50.12 0.05 OUTLIER Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.488 -0.324 . . . . 75.33 112.575 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.455 ' NH1' ' HG2' ' A' ' 4' ' ' GLU . 27.9 ttt180 -137.66 -64.42 0.55 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.092 0.472 . . . . 74.32 111.203 178.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.568 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 42.6 m -83.05 170.96 14.28 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.219 0.533 . . . . 75.11 112.433 -172.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -110.88 -93.21 2.18 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 116.033 -0.531 . . . . 75.11 113.783 -176.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.88 -50.13 61.6 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.862 0.69 . . . . 72.01 112.862 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.531 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 90.5 m -64.3 -40.48 96.02 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.866 0.365 . . . . 75.13 111.635 -177.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.568 ' OG ' ' HB2' ' A' ' 33' ' ' SER . 62.2 m -66.06 -42.19 89.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.712 0.291 . . . . 43.53 111.453 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -68.87 -52.77 26.14 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.627 0.251 . . . . 74.41 111.335 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HB2' HG11 ' A' ' 147' ' ' VAL . 20.6 ptmt -54.97 -39.49 69.03 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.958 0.409 . . . . 62.55 110.556 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.1 -53.2 33.05 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.261 -0.427 . . . . 74.33 111.706 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.559 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.0 tp -59.55 -40.51 87.49 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.521 0.563 . . . . 75.3 112.521 -176.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 12.3 pt-20 -73.4 -41.39 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.273 -0.267 . . . . 75.24 111.442 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.453 ' O ' HG22 ' A' ' 47' ' ' VAL . 82.7 m -69.26 -34.34 74.63 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 122.097 -0.377 . . . . 65.01 111.275 178.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -56.51 -44.05 80.37 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.883 0.327 . . . . 60.4 111.883 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.559 HH21 ' HG ' ' A' ' 41' ' ' LEU . 19.2 ptp180 -78.61 -32.38 47.47 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.996 0.427 . . . . 65.32 110.962 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.446 HH11 ' HD2' ' A' ' 46' ' ' ARG . 20.8 ttt180 -58.62 -44.88 90.11 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.061 -0.518 . . . . 75.22 111.759 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 43' ' ' THR . 32.8 m -91.66 -33.11 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.014 0.435 . . . . 74.25 111.223 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.46 -32.55 73.25 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 116.167 -0.47 . . . . 61.21 113.759 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.6 t70 -53.44 -56.65 15.08 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 117.088 0.444 . . . . 74.53 110.875 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.9 -43.79 81.63 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 121.018 -0.61 . . . . 32.31 113.066 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 47' ' ' VAL . 69.7 t -57.34 -46.06 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 112.039 0.385 . . . . 74.43 112.039 -178.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.468 HE22 ' HG2' ' A' ' 20' ' ' GLN . 57.3 mt-30 -63.12 -28.07 69.82 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.878 0.325 . . . . 75.13 111.878 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 46.9 mtt180 -69.29 -52.67 25.17 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 74.41 111.422 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -74.47 -23.06 58.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.824 0.345 . . . . 73.3 111.791 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.422 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 0.3 OUTLIER -82.66 -22.63 34.55 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.593 0.22 . . . . 72.34 111.593 173.351 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 43.1 tt0 -50.71 -56.6 11.21 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.102 0.408 . . . . 74.03 112.102 -176.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.4 t -54.89 -37.9 66.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.208 0.447 . . . . 72.2 112.208 -178.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.51 -46.04 50.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.893 0.378 . . . . 70.24 111.61 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.1 m-30 -64.63 -40.22 95.07 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.307 -0.406 . . . . 72.43 111.776 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.607 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 76.4 mm-40 -44.97 -55.07 5.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 120.779 0.323 . . . . 74.15 111.446 177.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.53 -34.76 49.99 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 116.154 -0.476 . . . . 64.33 113.961 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.8 mtm -79.46 -44.18 21.83 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.15 -0.618 . . . . 63.34 111.256 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.84 -32.81 69.75 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 111.665 0.246 . . . . 71.44 111.665 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 79.5 mtp180 -59.99 -34.87 73.91 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.364 0.602 . . . . 70.44 111.34 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -84.01 -38.88 20.36 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.95 -0.568 . . . . 62.21 111.153 177.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 77' ' ' LEU . 83.9 mt -69.56 -76.72 0.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.971 -0.559 . . . . 75.01 111.823 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 t70 43.67 85.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.312 0.577 . . . . 74.32 111.281 -172.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.7 mp -60.23 106.66 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 115.834 -0.621 . . . . 35.24 111.852 -174.028 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.77 -5.88 20.83 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.183 0.438 . . . . 71.42 112.183 -179.838 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -162.92 173.71 13.32 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.808 0.337 . . . . 64.42 111.865 174.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.28 -35.99 65.64 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.012 0.434 . . . . 53.4 111.907 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -51.55 -41.7 61.28 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.186 -0.461 . . . . 65.33 112.004 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.52 ' HB2' HG23 ' A' ' 68' ' ' ILE . 42.6 m-20 -60.47 -41.19 93.67 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.686 0.279 . . . . 73.54 111.285 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.24 -42.75 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.276 0.56 . . . . 70.21 110.936 178.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.02 -28.58 65.6 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.132 -0.485 . . . . 75.34 111.195 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -68.45 -37.31 80.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.168 0.508 . . . . 73.12 110.252 171.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 81' ' ' MET . 95.5 mt -60.43 -38.89 85.52 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.172 -0.467 . . . . 53.33 110.771 174.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.433 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.8 t -52.68 -37.92 59.67 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.121 0.486 . . . . 75.23 111.137 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -65.58 -40.33 92.6 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.141 -0.481 . . . . 75.1 110.514 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.93 -40.41 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.946 0.403 . . . . 72.03 110.896 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.5 mmt -57.17 -36.59 70.96 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.213 0.53 . . . . 72.42 110.759 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -62.08 -40.69 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 115.988 -0.551 . . . . 65.21 110.931 172.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 48.4 m80 -65.0 -32.6 74.41 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.007 0.373 . . . . 64.43 112.007 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.6 t -54.62 -41.21 54.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.027 0.441 . . . . 61.23 111.609 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 50.8 m-85 -85.37 -5.38 59.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.016 0.376 . . . . 75.15 112.016 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.6 t -83.59 -8.36 59.33 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.887 0.375 . . . . 73.24 111.292 178.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -50.85 -31.86 18.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.159 0.584 . . . . 73.21 112.181 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.07 -74.0 0.29 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 121.181 -0.533 . . . . 72.41 112.797 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 18.1 m -74.54 68.85 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.592 0.711 . . . . 74.23 111.497 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.62 ' HA ' ' HG3' ' A' ' 94' ' ' ARG . 57.2 m -68.61 84.15 0.28 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.313 0.578 . . . . 73.03 111.729 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -109.3 -177.02 3.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 55.55 110.907 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -63.24 -25.58 68.39 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.993 0.425 . . . . 73.42 111.166 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.75 -29.07 71.15 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 121.04 -0.6 . . . . 33.41 112.832 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.769 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 1.3 mmp_? -73.07 -32.38 64.98 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.495 -0.414 . . . . 71.23 111.001 176.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.7 mm -58.82 -44.73 91.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.239 0.543 . . . . 71.14 109.933 173.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 t -58.65 -43.83 88.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.814 -0.63 . . . . 70.15 110.762 174.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.4 m -54.79 -50.43 68.54 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.034 0.445 . . . . 72.3 111.218 177.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 34.9 tp -60.38 -54.83 40.89 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.833 -0.622 . . . . 72.41 112.111 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.83 -41.03 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.011 0.374 . . . . 71.41 112.011 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.1 p -59.75 -42.42 93.18 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.627 0.251 . . . . 75.34 111.336 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 21.7 t80 -63.05 -44.01 97.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.613 0.244 . . . . 53.35 110.932 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -45.93 93.4 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.051 -0.595 . . . . 70.25 112.917 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.91 78.71 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.035 0.445 . . . . 61.25 111.689 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -62.02 -43.43 98.86 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.024 0.44 . . . . 71.42 110.894 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.484 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 91.2 t -65.11 -38.33 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.405 -0.361 . . . . 62.51 110.678 176.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.99 -43.12 66.21 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.794 0.33 . . . . 64.21 111.609 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.688 ' HE2' ' HG3' ' A' ' 20' ' ' GLN . 61.9 mttm -56.61 -49.22 75.57 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.209 0.528 . . . . 71.14 111.295 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.507 ' O ' HG12 ' A' ' 112' ' ' ILE . 77.1 t60 -62.66 -35.38 79.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.145 -0.48 . . . . 73.14 110.938 179.297 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 117' ' ' SER . 96.1 mt -62.73 -49.52 74.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.34 -0.391 . . . . 74.23 110.977 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.482 ' HA ' ' HG3' ' A' ' 115' ' ' GLU . 85.8 tttt -57.99 -41.53 83.2 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.312 -0.403 . . . . 72.01 111.569 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 96.4 m -59.86 -41.58 91.8 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.13 -0.486 . . . . 63.3 111.849 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.507 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.5 pt -94.53 23.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.099 0.407 . . . . 74.44 112.099 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 70.37 1.36 3.57 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.096 0.776 . . . . 71.2 113.096 174.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 68' ' ' ILE . 15.1 mm100 -86.22 35.62 0.65 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 112.549 0.574 . . . . 71.35 112.549 -175.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.482 ' HG3' ' HA ' ' A' ' 110' ' ' LYS . 37.6 mt-10 -56.65 -31.76 64.7 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.671 0.272 . . . . 62.0 111.71 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 m -55.06 -32.35 61.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.002 0.43 . . . . 73.44 111.319 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . 0.499 ' HB2' HD13 ' A' ' 109' ' ' LEU . 50.1 m -70.17 -27.72 64.75 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.138 -0.483 . . . . 70.51 112.157 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.4 mt -54.51 -41.11 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.254 0.465 . . . . 64.54 112.254 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.554 ' HG2' ' NH2' ' A' ' 18' ' ' ARG . 30.8 mt-10 -65.57 -55.91 21.56 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 112.724 0.639 . . . . 73.32 112.724 -174.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.84 -28.15 51.1 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 121.78 1.653 . . . . 63.41 112.355 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.443 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.2 tt -64.29 -45.26 88.75 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 109.87 -0.419 . . . . 71.45 109.87 175.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.511 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -57.06 -37.61 72.06 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.969 0.414 . . . . 71.05 111.196 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.51 -36.52 73.81 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.179 -0.464 . . . . 73.22 111.718 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 80.0 p -62.58 -41.2 98.8 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 75.23 111.318 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.02 -52.91 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 63.4 110.975 177.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.9 m -69.55 -33.61 73.01 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.843 -0.617 . . . . 52.34 111.523 178.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.57 -52.91 63.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.684 0.278 . . . . 75.14 111.371 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.6 t -65.43 -41.16 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.11 0.481 . . . . 61.31 110.818 178.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.566 ' HG ' HD11 ' A' ' 137' ' ' LEU . 51.9 tp -54.81 -52.39 62.84 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.847 -0.615 . . . . 74.13 111.427 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.415 HG13 ' HD3' ' A' ' 134' ' ' ARG . 92.7 t -75.57 -26.94 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.142 -0.481 . . . . 75.21 111.708 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -60.53 -26.51 66.93 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.021 0.378 . . . . 73.13 112.021 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -131.44 -40.82 1.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.051 1.13 . . . . 71.41 114.051 -179.316 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.598 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.3 mptp? -103.25 20.64 17.34 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.692 0.997 . . . . 74.54 113.692 -174.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.541 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.9 ttp180 -56.05 -51.27 68.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.293 0.497 . . . . 74.31 111.607 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -57.39 -45.78 84.14 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.298 -0.41 . . . . 73.44 111.31 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -62.99 -38.33 90.74 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.411 -0.359 . . . . 64.33 111.586 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.566 HD11 ' HG ' ' A' ' 129' ' ' LEU . 65.1 mt -56.15 -49.74 73.09 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.916 0.339 . . . . 70.01 111.916 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.2 p -78.09 -42.25 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 112.166 0.432 . . . . 74.44 112.166 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -67.59 -62.47 1.4 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.169 0.433 . . . . 74.42 112.169 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.5 -8.69 59.31 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.809 0.338 . . . . 70.42 111.441 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 137' ' ' LEU . 46.2 mtt-85 60.62 83.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.551 0.691 . . . . 75.03 111.245 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -66.61 -52.92 31.03 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 115.291 -0.868 . . . . 64.22 114.125 -174.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.416 ' O ' HG23 ' A' ' 147' ' ' VAL . 50.2 m95 -68.0 -39.73 83.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.007 0.432 . . . . 73.14 111.437 -175.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -70.6 -52.8 19.03 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.788 0.327 . . . . 70.1 110.901 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -57.3 -38.87 88.88 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 116.182 -0.463 . . . . 63.34 113.446 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.57 -56.32 23.72 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.254 0.55 . . . . 73.0 111.59 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.557 HG11 ' HB2' ' A' ' 39' ' ' LYS . 90.1 t -59.93 -45.21 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.285 0.564 . . . . 72.34 112.053 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.613 ' HG2' ' HA ' ' A' ' 154' ' ' ASP . 40.1 mt-10 -73.68 -24.88 60.02 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.958 -0.565 . . . . 71.24 111.883 -178.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' PHE . . . . . 0.561 ' HA ' ' O ' ' A' ' 161' ' ' HIS . 78.3 t80 -58.05 -49.1 78.04 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.051 0.453 . . . . 71.11 110.835 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -82.52 -3.79 56.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.995 0.368 . . . . 75.44 111.995 178.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 24.1 t60 60.41 81.47 0.18 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.16 0.505 . . . . 72.41 111.702 179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 61.7 t -129.59 -67.39 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 121.21 0.528 . . . . 71.43 110.545 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -119.75 69.42 0.84 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.699 -0.682 . . . . 64.11 110.245 174.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.613 ' HA ' ' HG2' ' A' ' 148' ' ' GLU . 3.1 p30 -99.13 140.67 32.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.753 -0.658 . . . . 64.24 112.574 -175.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.49 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -109.93 -2.1 17.35 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.443 0.64 . . . . 72.43 109.719 172.041 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 160' ' ' HIS . 43.3 mt-10 80.2 -60.85 0.29 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 114.559 -1.2 . . . . 72.31 111.968 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 39.0 29.56 0.09 OUTLIER Glycine 0 CA--C 1.533 1.163 0 O-C-N 123.648 0.592 . . . . 53.2 114.308 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 71.73 -41.78 0.7 Allowed Glycine 0 CA--C 1.535 1.338 0 O-C-N 122.479 -0.424 . . . . 62.25 114.017 -174.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -92.38 4.29 53.7 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.737 1.014 . . . . 74.31 113.737 -169.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' HIS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 156' ' ' GLU . 28.7 p-80 -55.46 106.5 0.25 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.423 0.63 . . . . 73.41 110.449 175.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' HIS . . . . . 0.561 ' O ' ' HA ' ' A' ' 149' ' ' PHE . 38.6 m80 -72.38 86.03 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.828 0.677 . . . . 71.15 112.828 -169.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -84.6 -8.53 58.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.658 0.742 . . . . 74.15 109.352 169.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -146.18 150.09 35.19 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.118 -0.946 . . . . 71.3 110.206 172.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 26.5 t60 . . . . . 0 C--O 1.254 1.307 0 CA-C-O 118.551 -0.737 . . . . 74.15 111.596 -179.701 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.398 0.618 . . . . 75.01 110.764 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.19 178.19 8.96 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.646 -0.706 . . . . 60.45 111.433 -175.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.11 158.64 16.53 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.969 -0.56 . . . . 65.23 111.547 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -55.46 -37.27 67.54 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.394 0.616 . . . . 75.14 109.928 172.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.87 -41.47 74.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.545 -0.752 . . . . 65.25 111.554 174.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -67.41 -39.97 85.56 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.93 0.395 . . . . 71.45 110.565 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -67.18 -42.74 83.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.333 -0.394 . . . . 74.41 111.539 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.46 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.1 tt0 -61.61 -52.25 65.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.836 0.351 . . . . 64.14 111.222 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 p -58.86 -52.4 65.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.156 -0.475 . . . . 61.1 111.253 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' HG2' ' A' ' 123' ' ' GLU . 46.1 tp -54.55 -44.4 72.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.17 -0.468 . . . . 73.33 111.54 176.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.415 ' HG2' ' N ' ' A' ' 31' ' ' GLY . 5.3 tp10 -58.02 -51.03 71.37 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.114 0.483 . . . . 72.42 111.402 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 8' ' ' GLN . 75.0 mt -59.59 -52.41 61.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.182 -0.463 . . . . 75.4 111.34 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 17' ' ' LEU . 71.5 mt -62.62 -43.52 98.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 116.133 -0.485 . . . . 72.11 111.751 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 29.3 t -56.04 -54.87 39.73 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.966 0.412 . . . . 70.52 111.929 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' HD2' ' SD ' ' A' ' 30' ' ' MET . 85.5 mtt-85 -68.3 -34.35 75.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.543 -0.299 . . . . 61.41 111.326 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.401 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 48.7 t80 -59.71 -50.92 71.95 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.904 0.383 . . . . 73.24 111.332 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.8 mp -60.64 -37.94 83.14 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 122.288 -0.258 . . . . 75.53 111.488 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 14' ' ' SER . 49.8 mmm-85 -65.71 -56.71 10.64 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 111.875 0.324 . . . . 75.21 111.875 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 10.5 pt-20 -57.17 -39.13 74.71 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.989 0.424 . . . . 70.14 112.085 -178.183 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 35.5 mm-40 -68.03 -37.27 81.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.827 0.346 . . . . 75.33 111.303 177.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.23 -36.07 61.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.37 0.508 . . . . 54.0 112.37 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.416 HG22 ' HE3' ' A' ' 110' ' ' LYS . 71.9 p -85.8 -37.0 19.74 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.798 0.333 . . . . 65.21 111.669 -175.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.71 60.94 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.098 -0.572 . . . . 74.34 112.487 -177.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -146.76 144.5 29.43 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.856 0.36 . . . . 54.34 111.162 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.483 ' HD3' ' NH2' ' A' ' 45' ' ' ARG . 17.9 mmmt -72.82 151.94 41.78 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.622 0.725 . . . . 64.35 112.732 -178.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.9 175.08 5.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.758 -1.11 . . . . 72.53 111.659 -179.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.0 t -102.05 5.33 40.5 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.525 0.679 . . . . 71.3 110.5 172.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -109.24 143.45 27.73 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 115.709 -0.678 . . . . 65.03 112.18 -170.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.03 179.84 5.88 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.059 2.506 . . . . 63.53 113.137 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.649 ' SD ' HD22 ' A' ' 41' ' ' LEU . 88.1 mmm -92.47 -170.1 2.4 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.396 0.517 . . . . 73.13 112.396 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.415 ' N ' ' HG2' ' A' ' 11' ' ' GLU . . . -69.68 -176.22 15.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 116.102 -0.499 . . . . 52.5 114.192 -177.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' A' ' 32' ' ' ARG . 57.2 mtt180 -63.87 -15.04 58.0 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.821 0.674 . . . . 61.11 112.821 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.1 m -82.38 -1.65 50.56 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.84 0.311 . . . . 73.15 111.84 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 47.96 -102.08 0.05 OUTLIER Glycine 0 CA--C 1.529 0.908 0 N-CA-C 114.659 0.623 . . . . 61.41 114.659 172.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.23 -49.73 73.32 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.535 0.569 . . . . 53.21 112.535 -175.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.437 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 89.1 m -57.25 -46.34 83.12 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.931 0.396 . . . . 71.11 111.422 -179.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.406 ' HA ' HD11 ' A' ' 12' ' ' ILE . 22.7 p -70.47 -30.98 67.94 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.532 -0.304 . . . . 74.1 111.779 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -70.76 -56.14 7.04 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.656 0.243 . . . . 61.1 111.656 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.579 ' HG3' HG21 ' A' ' 147' ' ' VAL . 51.2 pttt -60.08 -37.26 79.37 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.739 0.304 . . . . 74.41 111.181 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.65 -46.76 89.08 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.714 0.292 . . . . 44.42 111.152 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.649 HD22 ' SD ' ' A' ' 30' ' ' MET . 52.4 tp -56.82 -54.1 50.24 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.993 0.425 . . . . 73.24 112.039 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 11.9 pt-20 -71.34 -26.4 62.81 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.332 0.493 . . . . 64.34 112.332 -176.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 47' ' ' VAL . 96.3 m -72.35 -36.47 68.81 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.976 -0.452 . . . . 73.02 110.734 173.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.1 mt -54.25 -49.92 68.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.049 0.389 . . . . 73.45 112.049 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.483 ' NH2' ' HD3' ' A' ' 25' ' ' LYS . 5.6 ptp180 -62.35 -42.36 99.33 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.424 0.527 . . . . 72.5 112.424 -176.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -72.69 -33.07 66.26 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.364 0.505 . . . . 73.31 112.364 -174.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -93.99 -29.64 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.911 0.386 . . . . 70.14 111.721 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -77.04 -50.57 6.75 Favored Glycine 0 CA--C 1.522 0.497 0 CA-C-N 116.229 -0.442 . . . . 72.45 113.936 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -53.02 -45.78 68.13 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 117.11 0.455 . . . . 61.04 111.406 -176.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.58 -47.44 90.03 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.105 -0.569 . . . . 75.12 112.839 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.9 t -57.77 -45.05 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.86 0.362 . . . . 64.11 110.905 176.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 76.6 mt-30 -56.32 -41.62 76.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.214 -0.448 . . . . 74.02 111.156 176.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -67.42 -47.7 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.382 0.512 . . . . 61.02 112.382 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -70.82 -32.83 70.02 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.283 0.563 . . . . 71.32 111.425 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -81.42 -18.37 45.64 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.247 -0.433 . . . . 74.25 112.077 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 35.1 tt0 -48.84 -43.56 38.71 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.578 0.585 . . . . 72.11 112.578 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.0 t -55.2 -34.67 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.928 0.394 . . . . 74.43 111.608 178.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.77 -41.37 21.27 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.368 -0.378 . . . . 63.21 111.799 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -64.7 -40.87 96.12 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.96 0.356 . . . . 63.15 111.96 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 11.3 mm100 -54.37 -36.31 63.75 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.8 0.333 . . . . 71.23 111.344 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.57 -31.7 63.87 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 116.188 -0.46 . . . . 74.53 112.834 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 59.1 mtm -89.27 -43.82 10.69 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.72 0.295 . . . . 54.12 111.019 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mp -53.07 -34.24 55.66 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.236 0.458 . . . . 73.44 112.236 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -66.09 -28.99 69.24 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.105 0.409 . . . . 73.33 112.105 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -9.24 23.15 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.121 0.486 . . . . 73.33 111.273 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -89.58 -74.87 0.46 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.31 -0.405 . . . . 75.31 111.155 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 t70 34.29 91.03 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.951 0.9 . . . . 72.35 112.249 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.49 HD12 ' N ' ' A' ' 68' ' ' ILE . 1.7 mp -64.3 104.21 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.87 -0.605 . . . . 64.43 111.888 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.73 -6.15 27.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.138 -0.483 . . . . 71.24 111.697 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.439 HD22 ' HB2' ' A' ' 72' ' ' ASP . 23.9 p-10 -161.13 164.72 30.43 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.766 0.317 . . . . 64.04 111.324 173.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.95 -30.66 64.25 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.381 0.512 . . . . 62.23 112.381 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' HD22 ' A' ' 70' ' ' ASN . 1.2 m-20 -54.65 -36.7 64.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.095 0.405 . . . . 74.41 112.095 177.033 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 54.7 m-20 -62.69 -43.15 99.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.03 0.443 . . . . 71.4 110.409 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.3 t -58.25 -48.22 85.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 116.029 -0.532 . . . . 54.33 111.014 177.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -59.83 -33.22 71.48 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.068 0.461 . . . . 74.34 111.095 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.1 t -70.12 -34.25 72.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.387 -0.37 . . . . 61.15 111.375 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.423 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.8 mt -58.35 -32.74 68.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.679 0.276 . . . . 72.22 111.111 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.2 t -52.76 -35.48 56.45 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.014 0.435 . . . . 65.12 111.167 176.021 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -63.63 -46.46 85.61 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.992 0.425 . . . . 74.44 110.57 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 84' ' ' VAL . 60.1 t -58.22 -43.07 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.396 -0.366 . . . . 75.21 110.629 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.3 mmt -56.58 -38.79 72.48 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.855 -0.611 . . . . 72.52 111.84 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 78' ' ' SER . 55.2 mt -65.1 -36.49 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.169 0.509 . . . . 51.11 110.95 175.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -74.85 -27.76 60.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.246 -0.434 . . . . 72.34 112.103 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 80' ' ' VAL . 70.8 t -52.2 -34.85 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 CA-C-O 120.859 0.362 . . . . 71.53 111.304 177.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.481 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.6 m-85 -81.38 29.6 0.36 Allowed 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 112.408 0.521 . . . . 74.34 112.408 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.2 t -84.91 4.14 34.86 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.98 -0.45 . . . . 71.21 111.958 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -55.6 -62.09 1.92 Allowed 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.166 0.508 . . . . 73.01 112.343 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 109.67 -38.49 3.29 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 115.911 -0.586 . . . . 41.42 112.183 -172.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 9.1 p -83.82 132.15 32.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 CA-C-O 121.321 0.582 . . . . 72.44 111.6 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 75.1 p -91.68 52.69 2.08 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.55 0.574 . . . . 75.44 112.55 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.411 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.9 OUTLIER -97.83 143.18 28.71 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 122.186 -0.321 . . . . 74.14 110.926 174.672 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -57.03 -21.29 29.96 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.608 0.596 . . . . 71.11 112.608 -177.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.55 52.98 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 121.185 -0.531 . . . . 70.14 113.309 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' A' ' 91' ' ' ASN . 6.9 ptm180 -70.24 -30.63 67.74 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.97 0.414 . . . . 54.31 111.264 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.36 -39.23 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 121.275 0.56 . . . . 61.35 109.622 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.02 -47.7 89.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.593 -0.731 . . . . 72.04 110.775 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.1 m -53.4 -45.81 69.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 111.873 0.323 . . . . 74.22 111.873 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.481 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 40.3 tp -61.23 -55.1 35.91 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.162 0.505 . . . . 71.03 111.909 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.0 mt -68.73 -38.82 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.262 -0.426 . . . . 52.41 111.75 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.9 p -65.1 -45.41 85.32 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.285 -0.416 . . . . 72.34 111.048 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 25.1 t80 -56.74 -40.57 75.99 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.762 0.315 . . . . 62.34 110.781 174.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -48.34 84.71 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.037 -0.601 . . . . 62.33 112.457 174.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.74 -32.35 73.85 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.886 0.374 . . . . 71.2 111.584 177.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -64.73 -46.85 80.51 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.974 0.416 . . . . 74.42 110.688 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.465 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 61.1 t -65.74 -36.77 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 116.347 -0.388 . . . . 63.33 110.227 175.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.91 -46.94 78.28 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.126 -0.488 . . . . 61.44 111.847 177.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -54.78 -47.6 73.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.416 0.627 . . . . 64.12 110.601 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.488 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.9 t60 -63.17 -36.71 84.52 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.714 -0.675 . . . . 74.12 111.31 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 73.9 mt -63.61 -51.07 66.87 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 111.634 0.235 . . . . 74.12 111.634 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HE3' HG22 ' A' ' 22' ' ' THR . 65.9 tttm -61.25 -38.61 87.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.151 0.501 . . . . 64.44 110.507 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 93.7 m -57.84 -45.94 85.5 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.853 -0.612 . . . . 65.44 111.397 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.4 pt -88.22 22.09 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 120.752 0.31 . . . . 74.34 111.789 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 69.34 14.14 8.49 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.885 0.698 . . . . 64.43 112.885 173.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -100.78 37.24 1.76 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.167 0.432 . . . . 75.44 112.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.517 ' HG3' HD12 ' A' ' 118' ' ' ILE . 43.3 tt0 -60.2 -34.27 73.4 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.928 -0.482 . . . . 74.54 111.86 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.2 m -57.02 -28.93 62.92 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 122.177 -0.327 . . . . 65.32 111.843 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.7 m -73.48 -26.81 61.07 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.078 0.399 . . . . 63.44 112.078 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.517 HD12 ' HG3' ' A' ' 115' ' ' GLU . 66.2 mt -55.2 -45.92 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.772 0.656 . . . . 44.25 112.772 -177.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.81 -52.38 42.3 Favored Pre-proline 0 CA--C 1.549 0.925 0 N-CA-C 112.693 0.627 . . . . 54.52 112.693 -174.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -59.04 -27.87 86.24 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.568 1.512 . . . . 72.43 112.354 173.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.416 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.8 tt -64.73 -44.95 88.49 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.837 -0.431 . . . . 72.25 109.837 173.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.512 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.26 -40.54 82.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.057 0.456 . . . . 70.1 111.099 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 10' ' ' LEU . 32.3 mt-10 -63.09 -36.63 84.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.088 -0.506 . . . . 74.22 111.119 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.2 m -65.27 -44.24 88.69 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.595 -0.275 . . . . 71.53 111.287 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' LEU . 48.7 mm -53.98 -53.13 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.131 0.491 . . . . 63.13 110.61 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -62.93 -39.84 95.81 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.669 -0.696 . . . . 74.21 111.625 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -54.35 -51.61 64.22 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.419 -0.355 . . . . 64.14 111.173 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 132' ' ' THR . 58.8 t -68.36 -46.27 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.296 -0.411 . . . . 60.11 111.13 177.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -51.56 -52.8 44.27 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.848 -0.615 . . . . 72.34 111.89 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 66.0 t -76.06 -32.19 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 116.194 -0.457 . . . . 45.33 111.861 -178.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -56.19 -39.38 72.34 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.042 0.386 . . . . 73.31 112.042 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.448 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.5 t -104.57 -42.64 5.37 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.886 0.699 . . . . 63.3 112.886 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.404 ' HD3' HG23 ' A' ' 132' ' ' THR . 12.4 mptt -102.47 26.12 8.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.681 0.623 . . . . 54.41 112.681 -176.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 1.1 tpm_? -45.28 -53.08 8.86 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.088 0.555 . . . . 74.31 112.256 175.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 3.9 m-20 -69.6 -52.19 28.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 73.34 111.779 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -58.85 -37.94 77.61 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.06 0.392 . . . . 73.44 112.06 -176.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 34.1 mt -54.79 -51.51 65.55 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.037 0.384 . . . . 75.4 112.037 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.446 ' HB ' HH21 ' A' ' 134' ' ' ARG . 14.8 p -79.0 -36.56 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 112.441 0.534 . . . . 72.52 112.441 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 73.9 mmtt -65.52 -45.71 82.44 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.286 0.476 . . . . 64.43 112.286 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -102.32 7.05 40.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.619 0.247 . . . . 74.53 111.561 -176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 52.81 71.79 0.46 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.27 -0.423 . . . . 64.44 110.802 -176.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -49.62 -44.91 38.42 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 114.638 0.615 . . . . 74.12 114.638 -172.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -75.29 -20.02 59.35 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.447 0.536 . . . . 63.41 112.447 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -84.28 -51.06 7.29 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.897 0.379 . . . . 75.45 110.327 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -54.3 -40.31 67.69 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.961 -0.563 . . . . 23.14 113.153 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.35 -53.46 57.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 122.704 0.402 . . . . 60.44 111.894 175.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.579 HG21 ' HG3' ' A' ' 39' ' ' LYS . 80.0 t -64.22 -42.73 96.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.002 0.43 . . . . 53.25 111.988 -177.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.489 ' HB2' ' HB3' ' A' ' 154' ' ' ASP . 12.8 pt-20 -73.91 -27.81 61.23 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.911 0.337 . . . . 60.44 111.911 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -56.15 -46.35 79.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.194 0.521 . . . . 73.23 111.464 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -82.48 4.0 26.07 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.132 -0.485 . . . . 62.45 111.553 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.8 m170 56.52 54.44 7.47 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.806 0.669 . . . . 74.21 112.806 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 56.0 t -83.98 -33.47 9.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.255 0.55 . . . . 71.35 109.873 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -117.0 -64.06 1.36 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.763 -0.653 . . . . 70.1 111.538 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.489 ' HB3' ' HB2' ' A' ' 148' ' ' GLU . 18.0 t70 -57.6 151.53 16.88 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.277 0.56 . . . . 74.25 112.491 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.579 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -126.92 23.92 6.53 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.03 -0.532 . . . . 73.3 112.315 -176.48 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -134.08 -67.19 0.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.161 0.505 . . . . 75.53 111.657 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -77.65 87.61 1.04 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 114.499 0.56 . . . . 74.05 114.499 -172.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -138.89 25.97 2.77 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.708 -0.557 . . . . 75.14 111.708 174.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -69.59 91.54 0.6 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.357 0.663 . . . . 75.31 112.179 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -154.13 129.88 10.07 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.402 . . . . 74.03 111.793 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -120.37 165.61 14.66 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.17 0.51 . . . . 74.03 111.513 175.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -116.12 99.08 6.99 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.098 -0.501 . . . . 71.31 111.064 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -77.52 144.55 37.57 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.13 0.49 . . . . 71.11 111.53 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 41.8 t60 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.781 -0.628 . . . . 64.21 110.83 173.598 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 tpt . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.998 0.428 . . . . 73.51 111.062 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -112.87 177.15 4.73 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.065 -0.516 . . . . 75.24 111.761 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -91.95 162.93 14.19 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 116.374 -0.375 . . . . 72.15 111.446 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.18 -47.83 80.24 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.254 0.549 . . . . 71.52 111.472 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -68.05 -36.54 80.05 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.804 -0.635 . . . . 64.3 110.704 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.39 -51.55 65.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.842 -0.617 . . . . 71.53 110.523 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 7' ' ' ARG . 7.4 tpt180 -65.47 -40.78 93.58 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.726 0.269 . . . . 64.31 111.726 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -57.62 -52.94 63.37 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.996 0.427 . . . . 72.32 110.968 174.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.06 -40.57 94.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.001 -0.545 . . . . 71.22 110.755 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 123' ' ' GLU . 42.1 tp -59.48 -44.83 92.96 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.958 -0.565 . . . . 43.51 111.518 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 42.7 tt0 -64.91 -50.34 66.89 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.748 0.309 . . . . 71.22 110.982 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.5 -48.03 80.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.884 0.373 . . . . 74.02 111.374 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.469 ' O ' HD13 ' A' ' 17' ' ' LEU . 81.0 mt -64.8 -44.67 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 116.492 -0.322 . . . . 64.4 111.43 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 38.5 t -53.96 -50.96 65.33 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.954 0.407 . . . . 74.15 111.109 177.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 61.7 mtt-85 -61.26 -49.19 78.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.225 -0.443 . . . . 74.34 111.105 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.404 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 20.1 t80 -53.95 -50.85 65.57 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.069 0.396 . . . . 64.23 112.069 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -55.77 -46.82 77.83 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.947 0.404 . . . . 74.22 111.352 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 14' ' ' SER . 35.2 mtp180 -66.02 -53.57 36.86 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 73.33 112.07 -179.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.531 ' CD ' HH21 ' A' ' 45' ' ' ARG . 15.1 pt-20 -62.59 -31.04 71.79 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 111.883 0.327 . . . . 72.34 111.883 -179.386 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.57 -27.92 58.77 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.936 0.398 . . . . 71.03 111.241 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.69 -40.7 17.06 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.945 0.402 . . . . 74.34 111.708 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.408 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 44.2 p -87.39 -37.19 17.28 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.003 0.43 . . . . 73.31 111.955 -177.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.53 10.48 55.56 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.263 -0.494 . . . . 32.41 112.767 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -142.19 126.0 17.08 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 122.546 -0.384 . . . . 54.22 111.957 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 170.46 6.79 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.15 0.5 . . . . 64.54 111.759 177.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -80.38 153.7 28.16 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.189 0.519 . . . . 62.41 111.826 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.4 t -94.76 31.68 1.77 Allowed 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.868 0.842 . . . . 64.1 110.225 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -111.88 158.19 37.42 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.511 -0.768 . . . . 73.22 111.671 -175.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.69 155.82 46.25 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.534 2.156 . . . . 73.4 112.671 173.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.5 mmm -84.8 -177.47 6.59 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.186 0.517 . . . . 74.42 112.159 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -68.1 179.15 19.82 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.515 0.566 . . . . 72.42 114.515 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.69 -24.76 2.44 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.222 1.193 . . . . 74.12 114.222 -173.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 m -83.23 -29.63 28.34 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 122.059 -0.401 . . . . 65.2 112.065 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.9 -100.37 1.46 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 120.841 -0.695 . . . . 73.5 112.443 -174.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -50.63 69.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.136 0.421 . . . . 71.45 112.136 -176.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.06 -33.62 72.31 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.008 0.432 . . . . 73.52 111.176 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.9 t -68.89 -40.99 78.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.38 -0.373 . . . . 64.13 111.15 178.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -62.61 -50.32 71.72 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.42 0.629 . . . . 63.0 110.539 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HE3' ' HB2' ' A' ' 153' ' ' GLU . 55.2 mtpt -57.78 -45.4 86.04 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.165 -0.925 . . . . 71.41 111.829 -178.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.439 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -59.4 -49.94 75.89 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.932 0.396 . . . . 62.43 111.383 177.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.9 tp -60.52 -52.6 64.52 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.268 -0.424 . . . . 71.2 111.862 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -61.02 -32.95 72.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.784 0.326 . . . . 50.11 111.589 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.499 ' O ' HG22 ' A' ' 47' ' ' VAL . 83.4 m -73.57 -41.4 62.97 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.269 -0.27 . . . . 60.34 110.836 177.113 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.8 mt -54.34 -45.64 72.73 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.142 0.423 . . . . 62.15 112.142 178.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.531 HH21 ' CD ' ' A' ' 19' ' ' GLU . 12.5 ptp180 -65.02 -42.26 94.56 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.169 -0.332 . . . . 74.11 111.705 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 46' ' ' ARG . 13.8 ttm180 -68.43 -45.29 72.98 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.921 0.341 . . . . 64.22 111.921 -176.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 21.0 m -86.32 -31.01 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.908 0.385 . . . . 70.5 111.709 -179.226 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.98 94.1 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.321 -0.466 . . . . 70.3 112.944 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.499 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 17.9 t70 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.881 0.372 . . . . 72.43 110.823 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.4 -46.42 80.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 121.307 -0.473 . . . . 52.52 112.966 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.66 -42.32 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 120.871 0.367 . . . . 63.21 111.168 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.539 HE22 ' HE2' ' A' ' 107' ' ' LYS . 27.9 mt-30 -63.25 -43.01 99.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.27 -0.423 . . . . 71.22 111.924 179.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 45.3 mtm-85 -58.2 -45.35 87.77 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.014 0.435 . . . . 70.01 111.611 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -73.87 -45.33 51.62 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.212 0.529 . . . . 72.35 111.656 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -77.27 -16.16 59.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.228 0.825 . . . . 63.44 113.228 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -46.87 -52.18 14.99 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.029 0.752 . . . . 74.23 113.029 -172.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 t -60.29 -30.62 69.58 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.022 0.379 . . . . 54.34 112.022 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.74 -50.94 11.37 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.983 0.421 . . . . 74.12 111.45 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -60.46 -42.26 95.8 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.167 0.432 . . . . 72.5 112.167 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -51.43 -39.88 58.25 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 111.955 0.354 . . . . 74.45 111.955 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.94 -34.74 72.96 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 121.289 -0.481 . . . . 64.02 113.253 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.485 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 49.1 mtm -89.77 -35.23 15.84 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.335 0.588 . . . . 63.21 110.314 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.555 HD21 ' HB2' ' A' ' 108' ' ' HIS . 14.7 tp -56.99 -42.41 80.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.616 -0.72 . . . . 64.02 111.793 -175.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.15 -15.47 63.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.961 0.726 . . . . 73.14 112.961 -177.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 0.74 19.32 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.24 0.543 . . . . 73.13 111.225 174.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 62' ' ' MET . 94.8 mt -96.23 -69.7 0.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.036 -0.529 . . . . 73.22 110.705 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 69.63 -52.08 0.62 Allowed 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 113.649 0.981 . . . . 62.34 113.649 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.436 HD11 HD21 ' A' ' 77' ' ' LEU . 2.4 mp 64.94 99.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.483 0.713 . . . . 65.31 111.478 -174.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.09 -14.89 13.82 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.306 -0.406 . . . . 72.44 112.019 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -150.56 173.45 14.09 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.625 0.25 . . . . 63.11 110.946 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.77 -35.48 68.71 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.557 0.577 . . . . 74.21 112.557 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -54.29 -42.26 69.86 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 122.311 -0.243 . . . . 62.52 111.472 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 44.3 m-20 -63.29 -43.54 97.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.094 0.473 . . . . 52.34 110.559 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.3 t -57.99 -46.7 87.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.932 -0.576 . . . . 75.4 111.189 176.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -69.61 -28.57 66.05 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.895 0.379 . . . . 70.15 111.481 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.7 m -68.33 -32.04 71.87 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.912 0.387 . . . . 64.34 110.778 174.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.475 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.6 mt -59.73 -34.26 72.71 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.732 0.301 . . . . 71.1 110.852 174.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.1 t -52.64 -35.73 55.33 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.27 -0.423 . . . . 63.13 111.576 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -58.25 -42.3 86.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.975 0.417 . . . . 74.43 110.969 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 65.9 t -73.46 -39.25 54.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.136 0.494 . . . . 73.41 110.845 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 98' ' ' LEU . 18.2 mmt -56.74 -39.92 74.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.04 -0.527 . . . . 74.23 111.532 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -60.0 -35.49 61.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.818 0.342 . . . . 43.11 111.389 175.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.423 ' HA ' ' OG ' ' A' ' 86' ' ' SER . 51.0 m80 -65.33 -39.45 92.44 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.895 0.378 . . . . 65.52 111.328 176.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.7 t -58.59 -32.83 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 120.893 0.378 . . . . 71.31 111.404 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.488 ' CE2' HD22 ' A' ' 98' ' ' LEU . 17.0 m-30 -106.68 24.9 11.93 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.504 0.557 . . . . 63.04 112.504 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.423 ' OG ' ' HA ' ' A' ' 83' ' ' HIS . 71.6 m -78.48 41.6 0.4 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.13 0.49 . . . . 70.41 111.722 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.444 ' OD1' HG13 ' A' ' 89' ' ' VAL . 6.8 t70 -158.93 170.36 22.28 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.451 -0.34 . . . . 64.01 110.75 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -128.13 15.27 6.17 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.08 -0.581 . . . . 70.31 113.976 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.444 HG13 ' OD1' ' A' ' 87' ' ' ASP . 13.4 m -63.66 139.03 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 117.52 0.66 . . . . 75.55 111.857 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 29.4 p -78.57 77.14 5.06 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.217 0.532 . . . . 63.14 111.459 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -141.0 113.38 8.04 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.865 -0.607 . . . . 62.31 110.704 178.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.45 ' HE3' HG13 ' A' ' 95' ' ' ILE . 33.1 m95 -63.9 -17.82 63.59 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.653 0.263 . . . . 73.45 111.457 178.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.97 -37.82 45.64 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.589 -0.338 . . . . 64.45 113.341 177.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 94' ' ' ARG . 22.2 mmt180 -66.31 -40.74 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 122.491 -0.417 . . . . 73.43 111.43 176.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.45 HG13 ' HE3' ' A' ' 92' ' ' TRP . 37.2 mm -61.53 -44.47 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.274 0.559 . . . . 73.51 110.062 175.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 92' ' ' TRP . 51.6 t -60.89 -41.15 87.72 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.831 -0.622 . . . . 70.24 110.963 175.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.1 m -55.44 -48.13 74.94 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.747 0.308 . . . . 53.44 111.277 178.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.557 HD11 ' SD ' ' A' ' 81' ' ' MET . 19.4 tp -62.56 -54.44 39.81 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.148 0.499 . . . . 71.12 111.501 -179.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.9 mt -64.85 -38.31 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.048 -0.523 . . . . 74.04 111.497 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -63.21 -45.5 91.41 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.223 -0.444 . . . . 64.41 111.168 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 105' ' ' VAL . 26.5 t80 -61.05 -39.17 88.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.735 0.302 . . . . 74.34 110.568 175.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.13 -47.35 88.25 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 121.022 -0.609 . . . . 51.04 112.474 174.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.32 -35.57 81.4 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.203 0.525 . . . . 62.5 111.471 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.07 -46.73 87.8 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.023 -0.535 . . . . 70.22 110.848 177.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 101' ' ' PHE . 46.4 t -65.56 -36.43 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 116.353 -0.385 . . . . 73.11 110.613 175.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.06 -39.43 69.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.338 -0.392 . . . . 64.43 111.721 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.539 ' HE2' HE22 ' A' ' 52' ' ' GLN . 67.9 mttm -58.42 -44.47 89.09 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.226 0.536 . . . . 75.22 110.932 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.555 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.1 t60 -65.66 -42.62 91.16 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.128 -0.487 . . . . 74.53 110.701 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.431 HD21 ' HB ' ' A' ' 68' ' ' ILE . 97.5 mt -59.66 -50.36 74.18 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.287 -0.415 . . . . 63.14 111.086 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HE2' ' HA ' ' A' ' 22' ' ' THR . 64.7 tttp -56.26 -43.8 79.07 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.282 -0.417 . . . . 74.21 111.412 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.0 m -60.69 -44.04 97.02 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.166 -0.47 . . . . 64.13 112.011 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 108' ' ' HIS . 34.3 pt -89.68 16.46 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 N-CA-C 112.308 0.484 . . . . 65.12 112.308 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 75.98 7.29 3.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.007 0.743 . . . . 61.54 113.007 175.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -82.72 33.69 0.43 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.551 0.34 . . . . 71.11 111.645 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.4 ' CD ' HH21 ' A' ' 18' ' ' ARG . 2.4 tm-20 -57.03 -30.76 64.49 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.043 0.449 . . . . 71.21 111.433 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.431 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 58.7 m -69.62 -39.66 77.06 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.18 -0.325 . . . . 53.2 111.636 176.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.6 m -54.69 -26.31 32.78 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.074 0.398 . . . . 64.35 112.074 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.0 mt -53.89 -39.18 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 112.097 0.406 . . . . 70.45 112.097 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.23 -54.99 16.74 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 112.518 0.562 . . . . 70.04 112.518 -175.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.431 ' HD2' ' O ' ' A' ' 116' ' ' SER . 20.9 Cg_endo -61.35 -26.85 82.15 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.769 1.646 . . . . 61.45 112.394 174.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.68 -47.44 75.44 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.776 -0.453 . . . . 74.41 109.776 174.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.5 -36.81 69.59 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.052 -0.522 . . . . 71.5 111.143 174.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HA ' HD13 ' A' ' 10' ' ' LEU . 44.7 mt-10 -63.85 -44.94 91.64 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.353 -0.385 . . . . 73.44 111.159 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -60.77 -45.25 95.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.786 0.326 . . . . 64.23 111.456 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.3 mm -53.76 -52.22 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.213 0.53 . . . . 43.2 110.734 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -66.32 -33.39 75.62 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.928 -0.578 . . . . 64.44 111.818 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.27 -51.63 65.34 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.833 0.349 . . . . 73.14 110.684 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 81' ' ' MET . 60.4 t -64.19 -36.73 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.017 0.437 . . . . 73.23 111.222 176.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.9 tp -57.51 -52.89 63.57 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.158 -0.474 . . . . 73.31 111.5 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 59.8 t -76.55 -24.66 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 116.426 -0.352 . . . . 72.41 111.658 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -44.74 -52.57 8.23 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.147 0.579 . . . . 74.42 112.513 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.04 -25.26 2.53 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.177 0.806 . . . . 72.11 113.177 -174.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 129' ' ' LEU . 1.1 mpmm? -85.27 11.39 10.17 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.647 -0.658 . . . . 73.05 111.847 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.404 ' HD3' HH11 ' A' ' 134' ' ' ARG . 9.0 tpt180 -47.39 -60.65 2.37 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 112.645 0.609 . . . . 64.52 112.645 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.93 -37.81 88.88 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 64.02 111.752 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -62.58 -38.98 92.21 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.751 0.31 . . . . 71.11 111.484 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.57 HD11 ' HG ' ' A' ' 129' ' ' LEU . 72.2 mt -59.79 -49.58 77.17 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.803 0.335 . . . . 44.21 111.67 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.9 p -75.44 -40.13 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.037 0.384 . . . . 61.13 112.037 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 36.4 mmtm -68.29 -44.09 76.25 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.386 0.513 . . . . 64.31 112.386 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -88.66 5.69 41.91 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.861 0.362 . . . . 71.11 110.99 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 59.57 29.28 18.83 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.084 0.554 . . . . 75.42 112.164 177.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.43 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 18.24 -86.93 0.0 OUTLIER Glycine 0 C--N 1.339 0.743 0 N-CA-C 115.917 1.127 . . . . 63.32 115.917 175.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.557 ' O ' HG23 ' A' ' 147' ' ' VAL . 14.1 m95 -75.09 -34.46 61.75 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.823 0.675 . . . . 70.21 112.823 -171.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -63.84 -52.49 59.88 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.04 0.448 . . . . 62.15 110.305 174.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.51 -35.6 92.14 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-N 115.863 -0.608 . . . . 50.13 112.718 178.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.17 -48.72 73.36 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.041 0.536 . . . . 64.42 111.998 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.4 t -65.1 -45.23 94.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.317 0.488 . . . . 62.32 112.317 -176.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.415 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 6.6 pt-20 -73.92 -27.46 61.04 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 122.143 -0.348 . . . . 64.44 111.872 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -57.09 -50.29 73.23 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.012 0.434 . . . . 71.25 111.326 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.37 -8.93 59.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.171 -0.468 . . . . 71.44 111.22 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 7.6 t60 65.27 71.91 0.43 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.475 0.71 . . . . 63.42 112.147 176.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.476 HG12 ' HG2' ' A' ' 153' ' ' GLU . 67.1 t -114.07 -63.47 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-N 116.109 -0.496 . . . . 64.14 110.757 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.476 ' HG2' HG12 ' A' ' 152' ' ' VAL . 10.8 mm-40 -125.85 70.7 1.21 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.008 -0.542 . . . . 74.42 110.091 177.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' A' ' 148' ' ' GLU . 2.8 p-10 -97.81 170.3 9.07 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.678 0.621 . . . . 74.43 112.678 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.701 HD13 ' H ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -116.57 -16.57 10.75 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 116.177 -0.465 . . . . 71.34 112.249 -179.433 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.432 ' N ' HD22 ' A' ' 155' ' ' LEU . 44.5 mt-10 65.68 -13.93 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.593 1.331 . . . . 63.31 114.593 172.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -72.53 -104.15 0.06 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.147 -0.549 . . . . 62.42 113.881 -178.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -89.95 110.77 3.79 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 121.249 -0.501 . . . . 32.41 112.959 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -171.07 172.36 5.44 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 120.715 0.293 . . . . 75.23 111.559 -177.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 13.7 m170 -147.65 113.78 5.85 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 112.077 0.399 . . . . 74.25 112.077 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -86.6 87.31 7.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.962 0.411 . . . . 74.52 110.614 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' HIS . . . . . 0.545 ' O ' ' HB3' ' A' ' 163' ' ' HIS . 34.8 m80 -71.23 77.21 0.72 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.476 0.547 . . . . 71.31 112.476 -176.342 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' HIS . . . . . 0.545 ' HB3' ' O ' ' A' ' 162' ' ' HIS . 0.1 OUTLIER 173.38 168.82 0.16 Allowed 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 120.808 0.337 . . . . 72.42 111.38 173.536 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.8 p80 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.722 -0.656 . . . . 75.43 111.412 172.506 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.407 ' O ' ' HG3' ' A' ' 1' ' ' MET . 21.4 ptm . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.412 0.625 . . . . 74.21 111.117 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -86.86 128.33 35.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.093 -0.503 . . . . 65.02 111.482 -175.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -55.58 156.61 4.58 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.866 -0.606 . . . . 74.53 112.179 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -52.02 -45.51 64.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.406 -0.361 . . . . 74.24 111.414 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.39 -41.81 73.17 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.006 0.373 . . . . 70.05 112.006 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -66.96 -51.92 49.2 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.869 0.366 . . . . 74.15 110.694 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -59.56 -37.12 77.62 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.226 -0.443 . . . . 72.35 111.284 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.402 ' CD ' ' HB2' ' A' ' 33' ' ' SER . 49.3 tt0 -65.4 -52.1 55.75 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.992 -0.549 . . . . 74.3 111.482 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.1 m -57.32 -48.48 78.86 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.283 -0.417 . . . . 73.12 110.912 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.11 -39.84 87.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.315 -0.402 . . . . 73.14 111.3 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.0 -52.1 66.91 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 72.44 111.526 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 60.1 mt -63.65 -53.14 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 115.964 -0.562 . . . . 72.41 111.51 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.1 mt -63.0 -49.33 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.979 -0.555 . . . . 74.13 112.144 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 t -54.6 -50.82 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.85 0.357 . . . . 62.14 111.091 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 52.2 mtt180 -55.09 -54.71 39.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.381 -0.372 . . . . 74.1 110.602 175.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -52.88 -44.93 67.25 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.547 0.573 . . . . 71.43 112.547 -175.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.3 mp -58.67 -51.43 69.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.643 0.259 . . . . 74.52 111.529 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -69.47 -26.31 64.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 120.75 -0.38 . . . . 72.3 111.894 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 6.3 mm-40 -64.34 -41.84 96.56 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.099 0.476 . . . . 74.33 110.652 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 25.7 mm-40 -72.26 -37.78 69.0 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.982 -0.554 . . . . 65.25 111.995 178.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.7 -43.65 88.51 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.92 0.391 . . . . 54.44 111.836 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.4 p -87.81 -37.81 16.25 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.847 0.356 . . . . 74.43 111.845 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.23 31.13 6.65 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.473 -0.394 . . . . 31.14 113.133 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.08 174.87 5.67 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.099 0.476 . . . . 63.5 112.222 -177.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -143.55 129.91 19.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.195 0.521 . . . . 75.43 111.785 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -105.85 153.15 22.34 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.097 -0.502 . . . . 53.33 110.857 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.7 t -149.85 11.51 0.75 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.925 0.393 . . . . 65.33 111.841 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -73.23 159.25 85.46 Favored Pre-proline 0 CA--C 1.541 0.617 0 O-C-N 122.265 -0.272 . . . . 75.24 111.582 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.42 107.15 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.413 2.076 . . . . 61.42 112.244 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 61.6 tpp -65.29 156.32 32.41 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.115 -0.493 . . . . 62.22 112.075 -175.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -77.7 -72.97 1.1 Allowed Glycine 0 CA--C 1.53 1.029 0 N-CA-C 114.27 0.468 . . . . 71.11 114.27 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -63.12 -59.45 4.76 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.587 0.588 . . . . 71.34 112.587 -173.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.682 ' HB3' ' HB2' ' A' ' 37' ' ' SER . 22.8 t -89.05 -74.67 0.46 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.41 0.522 . . . . 74.34 112.41 -177.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 38' ' ' ARG . . . 122.95 -110.06 1.48 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.344 -0.455 . . . . 55.54 112.175 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.5 -50.01 66.89 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.215 0.45 . . . . 72.01 112.215 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.458 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 86.8 m -57.08 -42.25 80.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.066 0.46 . . . . 55.52 111.394 -178.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.682 ' HB2' ' HB3' ' A' ' 33' ' ' SER . 42.7 t -64.26 -43.87 93.51 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.354 -0.385 . . . . 74.02 111.77 178.33 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 34' ' ' GLY . 44.3 mtp-105 -65.24 -53.45 44.29 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.771 0.286 . . . . 73.23 111.771 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HG3' HG21 ' A' ' 147' ' ' VAL . 19.6 ptmt -56.11 -37.51 69.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.103 0.478 . . . . 74.02 111.049 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.53 -47.3 70.3 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.415 -0.357 . . . . 73.51 111.213 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.2 tp -62.76 -38.54 90.97 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.23 0.456 . . . . 70.33 112.23 -177.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.11 -34.37 61.69 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.671 0.272 . . . . 54.21 111.508 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.533 HG23 HG21 ' A' ' 152' ' ' VAL . 88.3 m -75.9 -40.22 54.82 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 111.923 0.342 . . . . 53.11 111.923 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.4 mt -53.53 -35.28 60.54 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.61 0.596 . . . . 54.23 112.61 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.444 HH21 ' HG ' ' A' ' 41' ' ' LEU . 12.7 ptp180 -77.86 -42.01 34.93 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.04 -0.412 . . . . 54.31 112.097 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.407 ' NH1' HG13 ' A' ' 152' ' ' VAL . 17.0 ptm180 -68.71 -32.53 72.39 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.05 0.389 . . . . 70.22 112.05 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 22.3 m -94.14 -34.77 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 O-C-N 121.978 -0.451 . . . . 74.41 111.777 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.34 -48.8 49.73 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.439 -0.41 . . . . 72.42 113.605 -174.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 34.6 t70 -63.31 -36.11 82.59 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 122.438 -0.448 . . . . 70.03 110.778 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -49.96 70.71 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 121.147 -0.549 . . . . 64.44 112.488 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 47' ' ' VAL . 81.7 t -57.91 -43.26 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.963 0.411 . . . . 61.44 111.161 175.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.406 ' O ' ' N ' ' A' ' 56' ' ' GLU . 43.0 mt-30 -54.51 -45.8 73.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.118 -0.492 . . . . 74.32 112.074 176.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 24.3 mmm180 -65.29 -50.01 67.35 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.077 0.769 . . . . 61.45 113.077 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -69.72 -30.57 68.22 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.741 -0.599 . . . . 61.41 110.911 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -82.13 -18.51 42.64 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.287 -0.415 . . . . 72.53 112.008 174.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 52' ' ' GLN . 37.1 tt0 -49.84 -48.15 51.21 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.325 0.491 . . . . 74.05 112.325 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -52.44 -33.73 45.45 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.949 0.404 . . . . 63.24 111.735 176.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.55 -54.29 5.8 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.295 -0.411 . . . . 62.14 111.585 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -56.59 -35.9 68.77 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.353 0.501 . . . . 75.44 112.353 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -56.44 -39.69 73.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.953 0.406 . . . . 44.11 110.91 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.445 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -61.52 -23.24 62.47 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 121.235 -0.507 . . . . 73.23 112.463 176.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 79.6 mtp -86.72 -55.4 3.88 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.706 0.288 . . . . 72.01 111.177 176.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.93 -33.15 66.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.783 0.66 . . . . 52.53 112.783 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.445 ' HE ' ' HA2' ' A' ' 61' ' ' GLY . 53.2 ptt85 -64.12 -30.84 71.88 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.941 -0.304 . . . . 74.32 111.543 178.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.04 -4.04 28.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 122.152 -0.343 . . . . 72.03 111.748 177.281 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.95 -71.86 0.66 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.068 0.461 . . . . 71.43 110.532 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 44.27 87.73 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.095 0.958 . . . . 72.13 112.517 -177.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.561 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.8 mp -70.19 115.41 9.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 115.881 -0.6 . . . . 74.35 111.701 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.56 -14.97 13.14 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.394 0.516 . . . . 75.41 112.394 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -148.52 172.6 14.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.227 -0.296 . . . . 70.12 111.075 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.6 -29.62 70.74 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.354 0.501 . . . . 64.11 112.354 -175.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.59 -39.57 88.59 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.769 0.319 . . . . 71.31 110.868 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.561 ' HB2' HG23 ' A' ' 68' ' ' ILE . 55.6 m-20 -59.65 -40.47 87.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.148 0.499 . . . . 73.24 110.562 175.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.4 t -58.53 -46.48 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 116.068 -0.515 . . . . 71.44 111.142 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.18 -32.43 73.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.91 0.386 . . . . 74.13 111.149 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -65.48 -37.71 87.61 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.932 0.396 . . . . 55.14 110.372 174.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -60.01 -37.85 80.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.353 -0.385 . . . . 72.44 110.964 174.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -53.48 -42.67 67.48 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.957 0.408 . . . . 65.14 110.851 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 mmm-85 -59.91 -46.67 88.61 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.189 -0.459 . . . . 64.33 110.474 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.2 t -58.97 -39.16 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.891 0.377 . . . . 42.42 111.168 177.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.555 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.8 mmt -58.67 -38.02 77.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.166 0.508 . . . . 71.23 110.857 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.72 -38.94 74.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.978 -0.555 . . . . 72.24 110.904 173.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 5.8 m80 -68.89 -29.74 68.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.162 -0.472 . . . . 64.11 111.493 178.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 82.3 t -63.84 -28.27 44.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 120.901 0.381 . . . . 72.45 111.165 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 52.4 m-85 -93.81 10.19 34.15 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.452 0.538 . . . . 64.14 112.452 177.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.8 t -63.52 -46.9 83.93 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 121.17 0.509 . . . . 74.04 110.961 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.67 -70.26 0.19 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.705 -0.68 . . . . 73.2 111.735 176.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.92 54.95 15.45 Favored Glycine 0 CA--C 1.532 1.134 0 N-CA-C 114.524 0.57 . . . . 63.5 114.524 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.11 151.7 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 122.128 -0.631 . . . . 75.55 111.614 171.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 67.4 p -72.82 9.71 1.07 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.16 0.8 . . . . 72.3 113.16 -176.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -76.7 -7.73 55.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.884 0.327 . . . . 63.5 111.884 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.9 m95 63.86 -5.06 0.31 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.174 0.805 . . . . 70.02 113.174 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.78 -24.37 33.02 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.448 -0.406 . . . . 64.02 112.805 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HA ' ' HE ' ' A' ' 94' ' ' ARG . 2.3 mmp_? -57.47 -44.09 84.56 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.697 0.284 . . . . 73.45 111.078 174.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.8 mm -65.61 -49.96 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.026 0.441 . . . . 74.14 110.994 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' A' ' 146' ' ' PHE . 61.6 t -54.29 -52.87 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.006 -0.543 . . . . 74.33 111.276 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -58.04 -42.65 85.86 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.166 -0.47 . . . . 75.11 111.662 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.523 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 29.5 tp -58.83 -54.98 40.99 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.276 0.56 . . . . 43.31 111.552 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.5 mt -69.97 -35.58 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.038 -0.528 . . . . 75.12 111.501 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.3 m -65.71 -44.73 85.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.583 -0.28 . . . . 70.43 111.185 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 105' ' ' VAL . 30.8 t80 -61.7 -43.43 98.87 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.676 0.274 . . . . 74.44 110.809 176.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -46.08 93.14 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 120.92 -0.657 . . . . 60.41 112.481 175.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -34.02 76.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.914 0.387 . . . . 65.11 111.519 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -65.41 -45.72 82.82 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.322 -0.399 . . . . 73.22 110.703 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 46.1 t -66.37 -36.62 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 110.085 -0.339 . . . . 54.51 110.085 175.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.74 -43.72 85.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.179 -0.464 . . . . 64.43 111.534 175.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 97.5 mttt -55.42 -46.9 76.63 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.328 0.585 . . . . 73.21 110.716 174.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.412 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.9 t60 -64.7 -34.6 78.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.13 -0.487 . . . . 71.55 111.345 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.527 HD21 ' HB ' ' A' ' 68' ' ' ILE . 80.0 mt -64.45 -49.89 69.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.496 0.189 . . . . 75.43 111.446 178.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.459 ' HD3' ' O ' ' A' ' 110' ' ' LYS . 8.3 tmtm? -57.85 -39.44 77.73 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.209 0.528 . . . . 73.22 109.802 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 m -60.52 -33.58 72.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.07 -0.514 . . . . 65.53 111.817 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.5 pt -106.28 24.97 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 112.573 0.582 . . . . 64.24 112.573 -177.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 63.52 36.77 10.94 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.735 0.642 . . . . 62.4 112.735 175.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -117.32 33.01 5.83 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.746 0.308 . . . . 73.44 111.705 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.16 -30.97 40.2 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.104 0.409 . . . . 60.22 112.104 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.403 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 50.9 m -67.48 -37.12 82.39 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.775 0.321 . . . . 65.04 111.054 177.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.9 m -65.79 -27.2 68.1 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.093 0.405 . . . . 72.14 112.093 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.38 -39.28 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 112.476 0.547 . . . . 73.11 112.476 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -66.15 -55.54 20.49 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.604 0.594 . . . . 73.33 112.604 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.2 Cg_endo -59.78 -26.33 81.91 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 121.736 1.624 . . . . 72.5 112.113 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.3 tt -65.29 -48.22 73.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.811 -0.44 . . . . 63.52 109.811 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.14 -38.59 80.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.099 0.476 . . . . 73.21 111.226 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.39 -40.54 96.81 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 53.41 111.069 174.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.9 m -62.1 -46.66 88.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.799 0.333 . . . . 73.04 111.163 177.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 121' ' ' LEU . 45.8 mm -54.75 -51.9 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.283 0.563 . . . . 73.21 110.97 176.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.2 m -66.62 -39.2 88.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.812 -0.631 . . . . 60.24 111.89 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.603 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 30.5 t70 -59.54 -53.58 56.49 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.78 -0.191 . . . . 75.15 110.798 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.435 ' O ' HG22 ' A' ' 132' ' ' THR . 62.3 t -61.55 -43.43 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 120.908 0.385 . . . . 65.23 111.044 178.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.636 ' HG ' HD11 ' A' ' 137' ' ' LEU . 35.6 tp -49.6 -52.48 30.05 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.922 -0.581 . . . . 72.22 111.53 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.16 -34.51 26.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.332 0.586 . . . . 34.24 111.387 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 50.7 ttt180 -58.4 -33.36 69.56 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.831 0.852 . . . . 72.54 112.872 -174.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.642 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -116.66 -14.36 10.83 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.852 1.056 . . . . 51.34 113.852 -177.683 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.786 ' HZ2' ' HB3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.33 48.9 0.9 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.537 0.94 . . . . 71.25 113.537 174.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -51.69 -60.53 3.06 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.319 0.489 . . . . 74.11 112.319 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.82 -47.23 85.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.356 -0.384 . . . . 64.42 111.961 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 133' ' ' LYS . 95.3 m95 -53.32 -38.87 63.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.873 0.323 . . . . 74.33 111.873 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.636 HD11 ' HG ' ' A' ' 129' ' ' LEU . 46.0 mt -54.05 -51.13 65.03 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.228 -0.442 . . . . 74.35 112.167 177.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.68 -43.61 25.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 O-C-N 121.94 -0.475 . . . . 63.12 112.244 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -54.21 -52.63 60.65 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.174 0.512 . . . . 70.02 111.631 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -93.77 5.12 52.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.488 . . . . 72.44 111.43 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 59.31 38.76 23.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.38 -0.373 . . . . 73.31 111.945 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -27.04 -49.33 0.06 OUTLIER Glycine 0 N--CA 1.471 1.022 0 N-CA-C 116.238 1.255 . . . . 54.35 116.238 -173.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.423 ' O ' HG23 ' A' ' 147' ' ' VAL . 13.0 m95 -67.45 -51.39 52.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 117.733 0.766 . . . . 71.23 111.716 -178.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.82 -29.07 68.9 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.905 0.383 . . . . 73.44 111.11 174.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.546 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -69.43 -37.88 79.58 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.944 -0.463 . . . . 72.41 111.944 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.408 ' CE1' HG22 ' A' ' 96' ' ' VAL . 19.1 t80 -60.45 -41.4 94.0 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.175 0.512 . . . . 71.33 110.88 173.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.513 HG21 ' HG3' ' A' ' 39' ' ' LYS . 58.4 t -70.73 -38.21 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 116.033 -0.53 . . . . 74.42 112.314 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.546 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.4 pt-20 -74.0 -40.07 63.2 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 122.274 -0.266 . . . . 71.54 111.629 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -58.24 -48.34 80.71 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.978 0.418 . . . . 62.41 111.463 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -80.75 -9.13 59.83 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.439 -0.346 . . . . 73.01 111.148 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 67.5 t60 57.93 63.02 1.89 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.458 0.647 . . . . 72.43 112.19 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.533 HG21 HG23 ' A' ' 43' ' ' THR . 87.4 t -100.33 -69.92 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.979 -0.555 . . . . 63.52 110.21 177.005 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -100.89 68.16 1.27 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 71.11 109.752 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -159.63 166.74 30.04 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.266 -0.879 . . . . 64.44 111.255 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.574 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -129.77 -10.12 4.44 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 112.673 0.619 . . . . 64.02 112.673 178.24 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -147.06 -60.22 0.28 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.746 0.307 . . . . 75.04 111.314 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' GLY . . . . . 0.49 ' HA3' ' HB2' ' A' ' 148' ' ' GLU . . . 48.84 -121.62 8.23 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 115.966 -0.561 . . . . 44.31 113.752 -178.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 174.89 147.36 6.14 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.281 -0.485 . . . . 63.41 112.616 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -88.6 -10.62 48.08 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 122.393 -0.475 . . . . 75.13 111.389 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 53.99 18.92 1.82 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.254 0.835 . . . . 74.21 113.254 173.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -77.81 88.3 4.04 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.296 0.57 . . . . 74.52 111.906 -177.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -122.37 100.48 6.96 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.578 -0.737 . . . . 52.43 109.848 174.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -159.4 147.65 17.65 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.377 -0.374 . . . . 74.13 111.055 -174.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 82.7 t60 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.825 -0.607 . . . . 65.32 110.823 174.851 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.207 0.527 . . . . 55.12 111.223 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.35 -170.59 3.41 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.07 -0.514 . . . . 71.53 110.587 -177.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -140.52 177.32 8.09 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.675 0.274 . . . . 75.03 111.547 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.6 -41.0 98.36 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.074 0.398 . . . . 74.12 112.074 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 ' HB3' ' A' ' 137' ' ' LEU . 63.4 tp -60.26 -41.58 93.54 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.702 0.287 . . . . 74.34 110.615 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -57.06 -49.04 77.08 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.272 -0.422 . . . . 74.41 110.82 174.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -63.73 -43.49 96.34 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.884 0.373 . . . . 73.34 111.714 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.443 ' O ' HG13 ' A' ' 12' ' ' ILE . 54.3 tt0 -62.66 -52.24 64.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.159 0.504 . . . . 71.2 111.308 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.1 p -61.61 -44.39 97.08 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.007 -0.542 . . . . 75.34 111.09 177.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.3 tp -53.61 -45.04 69.92 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.232 -0.44 . . . . 54.25 111.44 175.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.21 -51.43 69.02 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.715 0.293 . . . . 64.53 111.571 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 8' ' ' GLN . 62.9 mt -55.8 -51.89 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.117 0.484 . . . . 75.45 111.386 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.405 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.8 mt -66.72 -49.76 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.996 -0.547 . . . . 71.11 112.195 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 87.9 p -55.5 -47.84 75.56 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.88 0.371 . . . . 75.41 111.601 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.415 ' NH1' ' HG2' ' A' ' 30' ' ' MET . 44.8 mtp180 -62.55 -41.94 99.22 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.406 -0.361 . . . . 73.05 111.615 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.415 ' OH ' ' HA3' ' A' ' 48' ' ' GLY . 56.0 t80 -61.07 -46.49 90.47 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.904 0.383 . . . . 74.32 111.043 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.1 mp -63.52 -34.56 78.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.47 -0.332 . . . . 64.52 111.601 177.388 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -62.95 -54.06 44.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.62 0.248 . . . . 65.44 111.477 176.552 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 42.5 mm-40 -63.0 -35.33 79.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.097 0.475 . . . . 74.01 111.624 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' A' ' 107' ' ' LYS . 71.6 mm-40 -72.37 -28.07 62.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.839 0.352 . . . . 73.04 111.724 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.6 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -72.89 -39.16 66.61 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 121.224 0.535 . . . . 74.2 110.928 175.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.5 p -87.62 -20.12 26.81 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.92 -0.582 . . . . 62.44 111.849 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.84 40.13 9.79 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 121.654 -0.308 . . . . 31.01 113.779 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' A' ' 19' ' ' GLU . . . -156.11 -163.12 1.4 Allowed 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.351 -0.499 . . . . 62.4 112.164 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -132.56 147.78 52.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.064 -0.516 . . . . 62.03 110.116 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.81 -172.84 2.19 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.823 0.821 . . . . 63.53 112.148 -178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.4 t -150.44 41.6 0.8 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 114.899 -1.046 . . . . 73.34 109.288 174.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -92.53 141.03 24.19 Favored Pre-proline 0 CA--C 1.541 0.6 0 CA-C-N 115.113 -0.949 . . . . 53.41 111.908 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 143.03 97.34 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.759 2.306 . . . . 71.11 112.897 175.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.415 ' HG2' ' NH1' ' A' ' 15' ' ' ARG . 64.7 mtp -94.59 179.0 5.41 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.942 0.401 . . . . 75.1 112.036 -178.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.65 -136.47 1.41 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 121.49 -0.386 . . . . 71.43 114.015 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -42.96 95.7 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 122.39 -0.477 . . . . 73.34 111.719 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.4 p -71.36 133.31 45.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.602 -0.272 . . . . 63.24 111.502 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.2 -95.17 2.22 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.19 -0.529 . . . . 60.35 113.167 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.1 70.21 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.996 0.739 . . . . 65.42 112.996 -173.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.1 m -54.7 -54.18 45.24 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 120.955 0.407 . . . . 73.54 111.856 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.2 m -71.85 -31.48 66.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.461 -0.336 . . . . 72.43 111.867 -177.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.3 tpt85 -64.02 -48.02 77.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 120.655 0.264 . . . . 65.31 111.438 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.425 ' HG3' HG21 ' A' ' 147' ' ' VAL . 6.1 ptmm? -76.2 -27.78 57.01 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.71 0.291 . . . . 65.2 111.41 178.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.57 -52.97 48.34 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.837 0.351 . . . . 61.22 110.948 174.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.5 tp -61.39 -38.27 86.43 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.176 0.512 . . . . 74.34 110.816 176.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.27 -40.52 90.67 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.92 -0.582 . . . . 64.03 110.827 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.621 HG23 HG21 ' A' ' 152' ' ' VAL . 93.6 m -69.64 -45.54 68.24 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.106 -0.497 . . . . 74.14 111.202 176.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.2 mt -54.28 -46.34 72.68 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.504 0.557 . . . . 72.21 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 45' ' ' ARG . 6.5 ptp180 -65.58 -34.11 77.48 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.152 -0.342 . . . . 73.12 111.447 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -73.07 -44.84 60.02 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 111.941 0.349 . . . . 74.41 111.941 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 51' ' ' VAL . 33.5 m -79.72 -34.12 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.793 0.33 . . . . 74.13 111.329 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' OH ' ' A' ' 16' ' ' TYR . . . -66.12 -39.35 94.59 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 121.459 -0.401 . . . . 53.3 112.859 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.99 -45.63 61.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.974 0.416 . . . . 72.35 111.417 174.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.44 -51.16 10.09 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 120.985 -0.626 . . . . 61.12 112.987 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.5 t -57.44 -53.48 43.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.372 0.508 . . . . 50.11 112.372 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -59.88 -44.81 93.99 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.204 0.446 . . . . 64.35 112.204 -177.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -65.44 -33.72 76.61 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.098 0.777 . . . . 74.11 113.098 -175.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -84.6 -34.14 23.21 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.336 -0.853 . . . . 74.42 111.062 176.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.6 m80 -75.47 -18.18 59.93 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.213 0.449 . . . . 72.31 112.213 177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.86 -55.19 10.37 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.644 0.609 . . . . 73.44 112.644 -174.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.8 t -58.93 -35.25 72.79 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.141 0.422 . . . . 62.22 112.141 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.72 -53.27 23.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.828 0.346 . . . . 74.11 111.649 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -63.92 -33.01 74.74 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.532 -0.303 . . . . 72.32 111.736 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 41.4 mm-40 -47.76 -46.79 30.56 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.554 0.216 . . . . 63.41 111.297 176.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.3 -41.07 61.64 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 121.233 -0.508 . . . . 74.11 112.913 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.466 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.9 mtp -70.51 -40.88 73.25 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.037 0.446 . . . . 75.31 111.081 178.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -62.2 -26.89 68.61 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.494 -0.321 . . . . 74.44 111.799 176.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 33.4 mtm180 -60.77 -26.57 67.33 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.233 0.457 . . . . 73.02 112.233 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 62' ' ' MET . 56.3 pttt -94.71 -8.98 36.19 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.863 0.363 . . . . 52.23 111.209 176.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.481 HD13 HD21 ' A' ' 77' ' ' LEU . 93.8 mt -105.92 -84.78 0.5 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.581 0.585 . . . . 71.22 112.581 -173.284 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.75 -22.41 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.529 0.937 . . . . 72.13 113.529 -173.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.466 HD12 ' N ' ' A' ' 68' ' ' ILE . 2.4 mp 59.34 95.65 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.659 0.783 . . . . 75.32 112.456 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.79 -8.65 18.62 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.604 . . . . 74.34 111.443 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -161.35 -179.71 7.61 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.377 -0.374 . . . . 71.22 110.674 175.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 34.8 tt0 -59.74 -37.26 78.47 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.837 0.31 . . . . 65.44 111.837 -178.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -54.28 -36.13 63.32 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 111.863 0.32 . . . . 72.24 111.863 -174.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -61.75 -44.39 97.0 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.317 0.58 . . . . 73.54 110.618 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.03 -36.97 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 121.265 0.555 . . . . 60.02 110.828 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.6 mmmt -65.13 -31.34 72.49 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.025 0.44 . . . . 71.32 110.577 176.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -67.78 -40.39 83.97 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.059 0.456 . . . . 74.53 110.609 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.573 ' O ' ' HG2' ' A' ' 81' ' ' MET . 96.7 mt -55.91 -40.3 72.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.133 -0.485 . . . . 71.22 110.93 175.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.8 t -54.86 -44.5 74.06 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.018 0.437 . . . . 34.33 111.069 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -57.92 -44.23 86.75 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.147 -0.479 . . . . 74.42 110.803 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 84' ' ' VAL . 57.6 t -61.08 -41.81 90.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.207 -0.452 . . . . 64.0 111.131 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.4 mmt -57.7 -43.89 85.47 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.07 0.462 . . . . 62.12 111.241 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 68.6 mt -56.13 -41.27 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.232 0.539 . . . . 73.23 110.87 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 59.3 m80 -74.76 -26.35 59.71 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.447 0.536 . . . . 72.21 112.447 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 80' ' ' VAL . 78.8 t -55.91 -33.09 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.135 0.493 . . . . 74.54 111.178 174.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.493 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.3 m-85 -81.98 14.95 2.49 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.485 0.55 . . . . 60.03 112.485 179.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.8 t -58.8 -37.03 75.46 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.931 0.396 . . . . 72.43 110.975 176.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.02 85.37 0.09 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.426 0.632 . . . . 72.24 112.08 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.65 54.59 4.64 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 116.05 -0.523 . . . . 72.03 112.11 174.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.0 m -114.57 165.8 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 120.853 0.359 . . . . 74.24 111.479 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 m -78.82 69.25 4.96 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.366 0.603 . . . . 61.3 111.141 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -148.04 158.87 44.3 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.931 -0.577 . . . . 53.0 111.409 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.404 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.1 m95 -106.11 -5.18 19.59 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.198 -0.455 . . . . 71.42 111.413 176.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.46 -35.79 51.96 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 121.428 -0.415 . . . . 63.1 113.225 177.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -54.82 -40.41 69.53 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 111.998 0.37 . . . . 72.24 111.998 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.401 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.8 mm -66.64 -46.47 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 120.905 0.383 . . . . 52.3 110.839 177.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.7 t -57.93 -43.33 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 120.978 0.418 . . . . 74.14 110.838 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.1 m -59.82 -42.25 93.09 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.168 -0.469 . . . . 63.21 111.239 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.528 HD12 ' SD ' ' A' ' 81' ' ' MET . 29.1 tp -59.54 -54.67 43.82 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.258 0.552 . . . . 53.32 111.67 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.4 mt -69.7 -39.99 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 115.991 -0.549 . . . . 73.41 111.873 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.2 p -63.45 -45.76 89.38 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.593 -0.276 . . . . 72.33 111.743 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.66 -43.27 93.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.795 0.331 . . . . 72.14 111.018 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.43 -45.47 92.93 Favored Glycine 0 CA--C 1.529 0.906 0 C-N-CA 120.904 -0.665 . . . . 61.4 112.314 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.34 -35.32 80.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.113 0.482 . . . . 73.23 111.647 177.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -64.75 -40.82 95.93 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.151 -0.477 . . . . 73.14 111.242 178.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 59.9 t -71.9 -38.44 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 120.838 0.352 . . . . 72.12 110.673 176.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.43 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.68 0.622 . . . . 73.13 112.68 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -61.27 -38.89 88.38 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.849 0.357 . . . . 71.51 111.494 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.437 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.4 t60 -65.59 -36.71 84.54 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.746 0.308 . . . . 74.35 110.703 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 81.4 mt -62.95 -50.44 70.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.489 -0.323 . . . . 42.22 111.859 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.836 0.35 . . . . 51.03 111.075 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.2 m -57.48 -37.82 73.53 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.403 -0.362 . . . . 53.42 111.737 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.6 pt -97.56 21.66 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 120.913 0.387 . . . . 70.24 111.646 177.499 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 68.75 6.81 5.75 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.637 0.977 . . . . 72.01 113.637 174.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -82.87 40.92 0.71 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.281 0.474 . . . . 63.12 112.281 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.0 -33.01 72.58 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.859 -0.526 . . . . 74.31 111.27 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 38.8 m -56.74 -28.09 60.51 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.519 -0.31 . . . . 73.31 111.435 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.9 m -79.24 -27.04 42.4 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.769 0.318 . . . . 74.43 111.834 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.5 mt -59.73 -41.39 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.482 0.549 . . . . 74.32 112.482 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -62.2 -56.42 31.26 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 112.402 0.519 . . . . 65.32 112.402 -178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.19 -30.23 90.82 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.846 1.697 . . . . 62.33 112.419 176.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -64.14 -50.18 69.22 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 109.66 -0.496 . . . . 61.42 109.66 174.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.75 -41.54 77.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.008 -0.542 . . . . 74.34 111.381 177.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -61.91 -46.19 90.46 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.448 -0.342 . . . . 71.31 111.009 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.9 m -56.4 -38.34 71.39 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.206 0.447 . . . . 44.05 112.206 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.4 mm -57.2 -53.88 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.204 0.526 . . . . 72.41 111.014 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 38.3 m -71.41 -33.76 69.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.935 -0.575 . . . . 71.54 111.453 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -59.82 -51.58 69.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.165 -0.471 . . . . 73.45 111.163 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.614 ' O ' HG22 ' A' ' 132' ' ' THR . 63.1 t -64.29 -48.89 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 120.87 0.367 . . . . 64.45 110.633 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.59 ' HG ' HD11 ' A' ' 137' ' ' LEU . 59.8 tp -49.21 -52.65 25.58 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.878 -0.601 . . . . 73.34 111.817 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.589 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -66.28 -52.24 49.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.231 -0.441 . . . . 55.01 111.519 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 131' ' ' ARG . 42.3 ttm105 -48.18 -46.08 34.42 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.89 0.7 . . . . 71.13 112.89 -176.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 128' ' ' VAL . 3.8 t -99.93 -28.76 12.93 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.082 1.141 . . . . 73.01 114.082 -173.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.57 ' HD2' HG23 ' A' ' 132' ' ' THR . 1.4 mptp? -131.82 31.05 4.27 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.529 0.937 . . . . 75.04 113.529 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.589 ' HD3' HG13 ' A' ' 130' ' ' VAL . 37.3 tpt85 -54.5 -45.96 73.37 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.018 0.437 . . . . 73.43 111.754 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.11 -50.85 72.47 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.049 -0.523 . . . . 62.35 111.703 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -57.79 -37.09 73.1 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 111.956 0.354 . . . . 74.21 111.956 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.59 HD11 ' HG ' ' A' ' 129' ' ' LEU . 77.6 mt -57.16 -48.56 78.4 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.11 0.411 . . . . 74.32 112.11 177.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.19 -36.83 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 122.156 -0.34 . . . . 61.31 111.753 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.45 -53.36 59.06 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.009 0.433 . . . . 75.1 111.865 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -93.89 7.01 46.59 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.118 0.414 . . . . 73.21 112.118 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 52.97 54.51 10.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.017 0.437 . . . . 72.53 110.509 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.404 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -30.94 -56.69 0.27 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 115.964 1.146 . . . . 71.21 115.964 -170.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.506 ' O ' HG23 ' A' ' 147' ' ' VAL . 18.6 m95 -69.87 -44.19 70.31 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 117.388 0.594 . . . . 74.51 112.548 -173.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.65 -51.2 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.927 0.394 . . . . 74.43 111.14 174.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.14 -38.37 85.52 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 116.059 -0.519 . . . . 61.14 112.803 178.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -57.83 -53.79 54.28 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.037 0.446 . . . . 64.23 111.527 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 143' ' ' TRP . 29.8 t -66.02 -42.5 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.135 0.42 . . . . 72.44 112.135 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.427 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.3 pt-20 -70.43 -34.15 72.15 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 122.168 -0.332 . . . . 63.2 111.544 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -62.2 -47.48 84.25 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.994 0.426 . . . . 73.34 110.816 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -79.78 -4.63 52.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.304 -0.407 . . . . 74.24 111.391 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.7 p80 43.02 39.75 1.94 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.109 0.963 . . . . 71.22 112.964 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.621 HG21 HG23 ' A' ' 43' ' ' THR . 56.1 t -65.05 -65.42 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.581 -0.281 . . . . 75.54 111.39 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -98.42 4.77 48.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.771 0.319 . . . . 72.53 111.342 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -135.11 175.99 9.08 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.451 0.644 . . . . 70.24 111.917 -174.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.506 HD13 ' H ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -138.43 9.0 2.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.399 -0.819 . . . . 74.04 109.967 171.88 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -93.88 21.63 6.42 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.393 -0.821 . . . . 74.12 112.271 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -151.67 -168.96 16.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.963 -0.637 . . . . 73.5 113.194 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 85.47 -79.91 1.85 Allowed Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.036 -0.602 . . . . 73.3 112.729 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -83.22 85.46 7.2 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.386 0.612 . . . . 70.04 110.169 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -131.72 134.31 45.76 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.675 -0.693 . . . . 75.23 111.375 -173.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -69.83 125.07 25.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.792 -0.448 . . . . 72.11 109.792 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -54.35 -53.65 51.07 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.652 0.612 . . . . 73.42 112.652 -172.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -86.88 93.57 9.34 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.961 0.41 . . . . 74.53 111.467 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.759 -0.639 . . . . 64.41 111.125 176.682 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 tpp . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 121.16 0.505 . . . . 72.21 111.321 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.459 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER -72.98 177.48 4.92 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.913 0.708 . . . . 72.3 112.913 -177.711 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -105.03 164.9 11.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.562 -0.744 . . . . 73.21 111.025 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.53 -46.18 77.1 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.016 0.436 . . . . 73.05 111.26 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.55 -34.11 70.67 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.109 -0.496 . . . . 63.14 110.773 177.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.444 ' CG ' ' HB2' ' A' ' 2' ' ' GLU . 11.1 t80 -67.23 -43.4 82.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.963 -0.562 . . . . 62.32 110.536 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 7' ' ' ARG . 7.7 mmt180 -67.85 -43.63 79.01 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.189 0.44 . . . . 74.32 112.189 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -58.0 -50.85 71.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.208 0.528 . . . . 64.35 110.693 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.3 p -64.04 -51.89 62.02 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.907 -0.588 . . . . 63.25 111.544 178.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 61.7 tp -51.98 -42.73 63.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 111.857 0.317 . . . . 74.43 111.857 177.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -57.78 -52.83 63.87 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.124 0.488 . . . . 74.33 111.044 177.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.51 -48.38 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.851 -0.613 . . . . 71.44 111.897 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 99' ' ' ILE . 75.3 mt -64.09 -52.52 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.359 -0.382 . . . . 65.34 111.968 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.7 p -52.78 -47.72 67.33 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.807 0.337 . . . . 73.01 111.637 -178.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 74.6 mtt180 -57.52 -51.26 70.17 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.648 -0.251 . . . . 63.13 110.8 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -53.22 -39.27 63.63 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.02 0.378 . . . . 72.43 112.02 -177.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.9 mp -62.93 -46.14 89.17 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.57 0.211 . . . . 73.11 111.57 176.154 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.67 -34.69 78.88 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.118 -0.364 . . . . 70.31 111.356 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.0 mm-40 -56.63 -51.76 67.47 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.306 0.574 . . . . 73.31 111.114 176.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.4 ' HB3' ' HE2' ' A' ' 107' ' ' LYS . 27.8 mm-40 -77.97 -23.42 48.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.962 -0.563 . . . . 70.35 112.495 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.01 -48.27 21.66 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.978 0.418 . . . . 64.21 111.59 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.445 HG22 ' HE3' ' A' ' 110' ' ' LYS . 32.8 p -92.07 -38.77 12.01 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.095 0.405 . . . . 60.0 112.095 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.88 16.4 63.44 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 121.217 -0.516 . . . . 65.15 112.696 -175.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.43 114.54 15.68 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.7 -0.294 . . . . 51.41 111.373 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -67.33 151.88 46.69 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.674 0.62 . . . . 72.21 112.674 -176.564 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -99.86 -168.78 1.65 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.003 0.43 . . . . 74.14 111.06 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -152.28 29.13 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.208 0.528 . . . . 35.54 111.565 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -76.04 150.52 83.42 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-O 120.958 0.409 . . . . 61.13 111.76 -178.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.46 130.0 33.68 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.701 2.267 . . . . 63.13 112.765 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 20.8 mmt -69.92 158.44 35.57 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.736 0.303 . . . . 73.12 111.677 176.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.42 -81.26 0.08 OUTLIER Glycine 0 CA--C 1.531 1.047 0 C-N-CA 121.136 -0.555 . . . . 34.15 112.927 176.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -137.23 159.16 42.71 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.515 -0.403 . . . . 34.2 111.375 176.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.4 m 63.55 88.19 0.1 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.379 0.672 . . . . 74.0 111.398 -174.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.9 -58.84 8.95 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-N 115.808 -0.633 . . . . 35.24 113.122 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.77 -50.11 71.33 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 111.837 0.31 . . . . 53.1 111.837 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -61.68 -53.25 58.59 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.015 0.376 . . . . 54.24 112.015 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.2 m -60.83 -33.06 72.46 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.842 0.353 . . . . 64.5 111.635 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 -68.03 -56.53 8.57 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.841 0.353 . . . . 73.44 111.408 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 16.9 ptmt -64.41 -32.05 73.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.403 -0.362 . . . . 72.03 111.518 -177.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -47.5 78.9 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.842 0.354 . . . . 70.43 111.089 175.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HG ' HH21 ' A' ' 45' ' ' ARG . 51.7 tp -64.67 -38.0 89.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.286 0.476 . . . . 73.02 112.286 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 12.1 pt-20 -75.79 -34.67 60.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.002 -0.436 . . . . 73.03 111.415 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.536 ' OG1' HG21 ' A' ' 152' ' ' VAL . 56.8 m -67.47 -38.67 84.75 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.083 -0.386 . . . . 53.51 111.138 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.64 -43.87 69.12 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.925 0.342 . . . . 74.41 111.925 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.504 HH21 ' HG ' ' A' ' 41' ' ' LEU . 16.0 ptp180 -78.72 -36.65 43.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.828 0.346 . . . . 74.22 111.176 177.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.483 ' NH1' HG13 ' A' ' 152' ' ' VAL . 32.4 ttt180 -57.12 -43.13 82.03 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.169 0.587 . . . . 74.42 112.163 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -101.59 -33.96 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.855 0.36 . . . . 63.52 111.642 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.454 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -61.96 -35.9 92.07 Favored Glycine 0 C--N 1.333 0.375 0 CA-C-N 116.317 -0.401 . . . . 75.11 113.614 -177.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 28.4 t70 -54.68 -55.49 29.13 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.064 0.459 . . . . 75.3 110.981 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.05 99.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.13 -0.557 . . . . 53.41 112.752 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 47' ' ' VAL . 65.6 t -57.28 -46.98 85.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 O-C-N 122.659 -0.318 . . . . 70.22 111.504 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.9 mt-30 -55.86 -46.66 78.18 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.655 0.264 . . . . 44.15 111.158 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 35.3 mtp85 -60.92 -41.12 95.55 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.179 0.437 . . . . 63.11 112.179 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -71.48 -37.57 71.29 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.242 0.544 . . . . 74.02 111.496 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -83.83 -19.05 35.62 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.646 0.61 . . . . 64.31 112.646 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 38.9 tt0 -49.17 -55.3 12.85 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.298 0.481 . . . . 64.32 112.298 -174.081 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -52.17 -34.78 46.5 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.904 0.383 . . . . 61.34 112.0 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.47 -42.39 59.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.87 0.367 . . . . 72.43 111.719 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -69.87 -34.36 73.48 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.12 0.415 . . . . 73.32 112.12 -178.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 84.0 mm-40 -51.04 -38.24 50.24 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.084 0.469 . . . . 71.14 111.322 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.508 ' HA2' HH11 ' A' ' 64' ' ' ARG . . . -58.67 -33.0 70.62 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.01 -0.541 . . . . 75.42 113.861 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.486 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 71.0 mtm -90.05 -45.31 9.24 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.293 -0.533 . . . . 75.32 111.717 178.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.22 -29.52 61.11 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.517 0.562 . . . . 65.02 112.517 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.508 HH11 ' HA2' ' A' ' 61' ' ' GLY . 18.3 ptt-85 -65.24 -19.0 65.76 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.748 0.309 . . . . 63.12 111.737 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.0 3.46 8.69 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.881 0.697 . . . . 64.25 112.881 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 62' ' ' MET . 82.5 mt -90.25 -77.32 0.4 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.904 0.335 . . . . 73.02 111.904 178.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 52.52 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.654 0.74 . . . . 73.43 112.49 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.53 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -77.86 99.12 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 115.62 -0.718 . . . . 62.44 110.532 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.86 -9.87 16.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.961 -0.563 . . . . 72.55 112.194 -176.992 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.46 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -157.46 173.75 16.43 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.845 0.355 . . . . 61.5 111.431 173.266 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -56.53 -39.67 73.77 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.16 0.8 . . . . 62.3 113.16 -171.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -54.34 -34.46 61.1 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.739 0.304 . . . . 52.03 111.344 -177.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.53 ' HB2' HG23 ' A' ' 68' ' ' ILE . 49.3 m-20 -63.39 -46.25 87.31 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.025 0.441 . . . . 60.11 110.849 176.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 80.3 t -58.28 -46.07 89.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.378 0.608 . . . . 73.22 110.512 176.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 6.6 mtpm? -64.16 -28.0 69.46 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.765 -0.652 . . . . 75.5 110.915 177.546 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 55.4 m -73.03 -36.36 66.95 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.897 0.379 . . . . 42.3 110.789 174.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -61.72 -37.09 82.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.482 -0.326 . . . . 72.42 110.896 175.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 t -52.78 -39.52 62.35 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.188 0.518 . . . . 71.53 111.135 176.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -62.6 -38.78 91.53 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.926 -0.579 . . . . 72.42 110.896 177.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.71 -42.89 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.876 0.369 . . . . 73.33 110.74 175.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 20.7 mmt -54.96 -40.98 70.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.017 -0.538 . . . . 74.34 111.256 178.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.2 -43.05 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.091 -0.504 . . . . 72.11 111.013 175.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -67.06 -28.77 68.47 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.087 -0.506 . . . . 70.03 112.064 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 91.8 t -55.46 -35.05 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.112 0.482 . . . . 55.42 111.366 177.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.532 ' HA ' ' NH2' ' A' ' 94' ' ' ARG . 73.8 m-85 -95.54 29.22 2.66 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.128 0.418 . . . . 64.3 112.128 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 67.0 p -74.59 -43.84 53.64 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.271 0.471 . . . . 61.11 112.271 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.32 157.41 37.07 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.069 0.461 . . . . 71.33 111.812 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.38 66.38 0.3 Allowed Glycine 0 CA--C 1.527 0.815 0 N-CA-C 114.477 0.551 . . . . 43.11 114.477 -172.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.418 HG13 ' HD2' ' A' ' 94' ' ' ARG . 10.8 p -135.38 143.99 35.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 122.453 -0.439 . . . . 54.41 111.01 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.9 t -94.63 28.5 2.62 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.088 0.773 . . . . 73.31 113.088 -172.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -72.81 123.81 24.12 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.987 -0.445 . . . . 61.21 111.436 178.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.459 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 94.0 m95 -61.86 -17.81 57.82 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 111.875 0.324 . . . . 73.32 111.875 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.74 -24.59 49.12 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.276 -0.488 . . . . 73.0 112.999 174.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.532 ' NH2' ' HA ' ' A' ' 85' ' ' PHE . 73.1 mtp180 -66.65 -43.04 85.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.938 0.399 . . . . 74.15 110.452 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.72 -43.44 95.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.217 0.532 . . . . 74.25 110.297 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.1 t -60.54 -42.71 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.929 -0.578 . . . . 54.32 110.959 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.9 m -60.87 -42.56 98.13 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.93 0.395 . . . . 63.34 111.162 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 27.0 tp -59.66 -54.64 44.1 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.263 0.554 . . . . 73.35 111.515 177.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 13' ' ' ILE . 59.4 mt -69.1 -37.84 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-N 116.073 -0.512 . . . . 72.05 111.746 -177.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.5 p -65.6 -40.37 92.6 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.33 -0.231 . . . . 55.32 111.311 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -62.22 -42.3 99.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.666 0.27 . . . . 65.34 110.506 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.76 -47.2 87.44 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.914 -0.66 . . . . 44.55 112.219 174.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 107' ' ' LYS . . . -66.42 -34.65 78.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.946 0.403 . . . . 50.22 111.582 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -64.87 -45.51 85.7 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.044 0.449 . . . . 73.54 110.679 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.75 -37.49 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 116.335 -0.393 . . . . 63.31 110.584 175.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.74 -40.85 66.49 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.212 -0.449 . . . . 74.13 111.793 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 93.7 mttt -57.28 -49.36 76.34 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.111 0.482 . . . . 75.2 110.651 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.438 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.5 t60 -64.68 -33.2 75.39 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.103 -0.499 . . . . 72.43 110.996 178.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.508 HD21 ' HB ' ' A' ' 68' ' ' ILE . 76.6 mt -62.95 -50.78 69.47 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.619 -0.264 . . . . 73.34 111.44 177.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.6 tttm -65.39 -27.41 68.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.984 0.421 . . . . 70.41 110.609 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.1 m -65.66 -31.67 72.82 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.115 -0.493 . . . . 73.44 111.382 175.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.8 pt -108.77 36.34 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-O 120.777 0.322 . . . . 73.3 111.455 177.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 p30 47.7 20.41 0.2 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.225 1.194 . . . . 51.4 114.225 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.17 35.71 0.81 Allowed 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.203 0.525 . . . . 74.53 110.879 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -56.69 -39.24 73.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.008 -0.542 . . . . 73.34 112.105 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 79.1 p -65.37 -27.63 68.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.491 -0.322 . . . . 55.25 111.643 178.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.5 m -68.57 -26.4 65.38 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.545 0.338 . . . . 74.1 111.81 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.23 -40.78 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 N-CA-C 112.62 0.6 . . . . 60.32 112.62 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.95 -52.52 23.87 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 112.852 0.686 . . . . 51.42 112.852 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.14 -27.14 84.27 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.88 1.72 . . . . 64.45 112.159 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.65 -46.36 82.86 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 109.831 -0.433 . . . . 64.41 109.831 172.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.56 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.07 -39.4 78.43 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.02 0.438 . . . . 61.15 111.132 174.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.62 -43.17 97.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.405 -0.361 . . . . 64.0 110.943 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.2 m -58.71 -47.47 84.44 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.886 0.374 . . . . 72.34 111.015 177.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.8 mm -52.7 -52.51 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.44 0.638 . . . . 63.41 111.087 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.8 m -67.04 -38.41 85.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.421 -0.809 . . . . 70.35 112.261 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.406 ' HA ' ' HE2' ' A' ' 6' ' ' TYR . 30.1 t70 -64.07 -51.15 65.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.674 0.273 . . . . 65.33 110.889 -178.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 67.0 t -60.4 -33.85 55.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.371 0.605 . . . . 65.42 110.944 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.546 ' HG ' HD11 ' A' ' 137' ' ' LEU . 38.8 tp -66.12 -54.04 30.52 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.999 -0.546 . . . . 74.53 111.917 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.447 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 61.5 t -76.49 -29.63 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 111.941 0.349 . . . . 65.2 111.941 -176.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.56 -49.94 66.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.989 0.423 . . . . 63.21 112.122 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.532 ' OG1' ' HD3' ' A' ' 133' ' ' LYS . 10.5 p -109.99 -39.23 5.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 75.32 112.402 -175.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.532 ' HD3' ' OG1' ' A' ' 132' ' ' THR . 2.7 mppt? -82.46 10.79 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.294 0.479 . . . . 72.34 112.294 -177.351 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 20.9 tpt180 -45.71 -61.24 1.79 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.849 0.685 . . . . 64.33 112.849 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.05 -49.06 79.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.071 0.462 . . . . 64.34 111.363 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -60.68 -36.93 79.97 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.156 -0.475 . . . . 72.41 111.996 -177.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.546 HD11 ' HG ' ' A' ' 129' ' ' LEU . 29.7 mt -59.35 -54.48 46.26 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.685 0.254 . . . . 73.22 111.685 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.8 p -71.11 -38.44 71.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 112.027 0.38 . . . . 54.15 112.027 -178.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -63.12 -46.02 89.27 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.122 0.416 . . . . 72.12 112.122 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -94.65 6.23 49.48 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.995 0.426 . . . . 73.43 111.317 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 62.05 26.63 16.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.92 -0.582 . . . . 63.45 112.281 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.459 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 25.83 -83.09 0.0 OUTLIER Glycine 0 N--CA 1.468 0.787 0 N-CA-C 115.903 1.121 . . . . 73.32 115.903 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.402 ' O ' HG23 ' A' ' 147' ' ' VAL . 12.5 m95 -75.34 -38.17 60.31 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.124 0.416 . . . . 62.02 112.124 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 20.0 m-20 -64.69 -48.08 76.01 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.922 -0.399 . . . . 75.53 109.922 173.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.53 93.19 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.148 -0.549 . . . . 64.44 112.492 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.05 -49.34 74.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.921 0.488 . . . . 71.43 111.164 174.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.512 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.5 t -68.89 -35.96 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 116.351 -0.386 . . . . 61.22 111.281 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 46.0 mt-10 -57.5 -47.54 81.65 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.088 0.47 . . . . 54.44 111.154 176.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -60.04 -48.96 79.53 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.077 -0.511 . . . . 75.44 111.728 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -83.94 -3.63 58.1 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.157 0.428 . . . . 74.22 112.157 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 154' ' ' ASP . 32.4 p80 44.59 86.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.92 1.082 . . . . 72.14 113.92 175.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.536 HG21 ' OG1' ' A' ' 43' ' ' THR . 81.8 t -98.67 -50.26 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 121.219 0.533 . . . . 74.11 110.691 176.32 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -105.19 -15.23 15.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.837 0.827 . . . . 75.23 109.572 170.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 0.5 OUTLIER -86.12 70.28 10.56 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.879 -1.055 . . . . 71.54 110.851 -174.576 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -23.82 6.37 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.454 0.909 . . . . 44.32 113.454 -174.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -74.76 -5.79 45.3 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.861 0.689 . . . . 72.21 112.861 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -76.1 42.32 1.62 Allowed Glycine 0 CA--C 1.533 1.17 0 C-N-CA 121.32 -0.467 . . . . 73.04 114.265 -177.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -86.09 104.24 2.86 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.3 -0.476 . . . . 62.14 111.922 176.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 18.2 p80 -115.4 99.4 7.35 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.638 0.607 . . . . 63.24 112.638 -174.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -91.13 -26.48 19.09 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.982 0.42 . . . . 71.12 110.575 174.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -63.38 113.91 3.53 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.987 -0.552 . . . . 75.51 111.51 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -92.44 108.73 20.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.213 -0.449 . . . . 75.54 111.982 -176.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 34.3 p80 -61.55 176.65 0.47 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 116.538 -0.301 . . . . 74.42 110.836 172.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 48.9 t60 . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.331 -0.842 . . . . 74.41 110.783 176.389 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 120.98 0.419 . . . . 72.13 110.625 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -106.63 143.14 35.16 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.969 0.414 . . . . 75.11 111.305 -175.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.08 162.93 28.75 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.194 0.813 . . . . 62.21 113.194 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -49.82 -47.57 51.33 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.334 -0.848 . . . . 74.31 111.61 175.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.456 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.3 tp -69.54 -36.54 76.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.815 -0.63 . . . . 74.34 111.413 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -68.12 -44.56 75.85 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.236 -0.438 . . . . 73.22 111.297 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.608 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 24.8 mmm180 -71.94 -32.77 67.66 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.224 0.453 . . . . 63.32 112.224 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 33' ' ' SER . 6.7 tp60 -64.16 -51.85 61.83 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.146 0.498 . . . . 73.45 111.07 174.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 p -61.68 -54.51 41.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.093 -0.503 . . . . 73.41 111.673 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.519 HD23 HH11 ' A' ' 7' ' ' ARG . 50.6 tp -54.35 -37.96 65.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.444 -0.344 . . . . 64.42 111.832 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.608 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 1.9 tm-20 -60.28 -53.43 57.79 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.263 0.554 . . . . 73.21 111.273 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.449 HD13 ' HB3' ' A' ' 40' ' ' ALA . 65.0 mt -63.5 -47.76 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.811 -0.631 . . . . 75.52 111.342 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.6 mt -61.64 -51.42 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.04 -0.527 . . . . 75.5 111.623 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -52.13 -50.05 62.47 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.05 0.452 . . . . 52.32 111.733 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.924 HH12 ' HB2' ' A' ' 28' ' ' LYS . 66.7 mtt-85 -62.78 -42.02 99.51 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.859 -0.337 . . . . 70.23 111.657 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -57.6 -44.08 85.16 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.38 . . . . 73.55 111.613 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.2 mp -56.84 -44.38 82.04 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.965 0.412 . . . . 72.22 110.571 174.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -66.52 -32.72 74.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.319 -0.4 . . . . 74.12 111.996 175.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 8.6 mm-40 -62.35 -41.99 99.04 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.354 0.597 . . . . 74.23 110.645 177.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -78.46 -30.67 47.53 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.636 -0.711 . . . . 73.5 112.207 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.32 -38.69 71.7 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.937 0.398 . . . . 74.43 111.739 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 63.6 p -87.05 -36.21 18.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.766 0.317 . . . . 64.31 111.715 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.63 19.74 65.37 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.06 -0.591 . . . . 71.14 111.966 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -124.16 -163.89 1.19 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.562 0.345 . . . . 64.04 111.293 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.458 ' HD2' ' O ' ' A' ' 26' ' ' ASP . 0.0 OUTLIER -120.65 151.52 39.38 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.962 0.411 . . . . 61.51 111.372 175.755 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' HD2' ' A' ' 25' ' ' LYS . 29.5 t70 -67.27 154.38 41.44 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.45 0.643 . . . . 75.1 112.601 -177.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 t -140.05 25.83 2.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.97 -0.559 . . . . 65.02 111.803 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.924 ' HB2' HH12 ' A' ' 15' ' ' ARG . 21.5 mtpp -128.52 164.14 40.06 Favored Pre-proline 0 CA--C 1.545 0.782 0 O-C-N 122.116 -0.365 . . . . 53.52 111.697 -173.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.478 ' HD2' ' HB3' ' A' ' 28' ' ' LYS . 29.8 Cg_endo -63.88 112.44 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.456 2.104 . . . . 71.42 112.613 178.01 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.563 ' HE1' HD22 ' A' ' 41' ' ' LEU . 57.1 mtp -83.74 -166.9 1.52 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.433 0.901 . . . . 53.11 113.433 -172.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.579 ' HA2' ' HG3' ' A' ' 11' ' ' GLU . . . -38.07 145.42 0.16 Allowed Glycine 0 C--N 1.341 0.814 0 N-CA-C 116.114 1.206 . . . . 64.15 116.114 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -54.2 -25.36 22.38 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.154 0.982 . . . . 74.32 113.619 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.501 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 26.6 m -78.83 0.0 28.83 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.457 0.54 . . . . 75.54 112.457 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.48 -119.58 10.41 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 121.324 -0.465 . . . . 73.21 113.953 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -51.09 -42.55 60.68 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.62 0.6 . . . . 74.14 112.62 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.5 m -54.86 -36.89 65.56 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.257 0.465 . . . . 64.25 112.257 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.3 p -69.77 -38.82 76.87 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.789 0.328 . . . . 74.43 110.81 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -61.62 -55.08 34.55 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.895 0.378 . . . . 73.42 111.365 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 20.6 mtpp -55.09 -45.18 75.41 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.001 -0.545 . . . . 61.41 110.875 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB3' HD13 ' A' ' 12' ' ' ILE . . . -60.48 -44.59 95.76 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.312 -0.404 . . . . 74.32 111.547 176.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.563 HD22 ' HE1' ' A' ' 30' ' ' MET . 59.1 tp -62.2 -54.46 40.63 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.336 0.495 . . . . 71.42 112.336 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.47 -22.37 63.64 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.995 -0.441 . . . . 63.21 111.864 -177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.54 HG23 HG21 ' A' ' 152' ' ' VAL . 61.3 m -73.5 -40.44 64.07 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 122.233 -0.292 . . . . 74.23 110.526 171.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 40' ' ' ALA . 42.3 mt -55.37 -42.34 73.79 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.058 0.392 . . . . 51.21 112.058 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.49 ' NH2' ' HB3' ' A' ' 19' ' ' GLU . 1.1 ptp85 -74.16 -36.05 64.06 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.007 -0.433 . . . . 74.23 111.865 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -63.41 -44.62 94.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.777 0.322 . . . . 73.33 111.664 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 51' ' ' VAL . 25.6 m -87.85 -33.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.813 0.339 . . . . 64.45 111.699 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.97 -29.97 72.35 Favored Glycine 0 CA--C 1.523 0.587 0 CA-C-N 116.308 -0.406 . . . . 63.11 113.265 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 12.3 t70 -51.19 -58.02 7.25 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.955 0.407 . . . . 74.13 110.968 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.02 -45.37 95.72 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.052 -0.594 . . . . 73.23 113.038 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 47' ' ' VAL . 95.0 t -56.8 -44.86 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 122.493 -0.416 . . . . 72.11 111.742 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 48.7 mt-30 -64.73 -38.65 91.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.855 0.317 . . . . 74.52 111.855 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 79.6 mtt-85 -61.67 -37.93 85.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.114 -0.366 . . . . 72.41 111.756 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -77.15 -46.0 24.88 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.006 0.431 . . . . 74.24 111.48 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -76.78 -21.21 55.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.033 0.753 . . . . 75.32 113.033 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -50.4 -55.01 17.62 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 112.265 0.469 . . . . 74.11 112.265 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -57.34 -27.69 62.46 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 120.867 0.365 . . . . 75.15 111.85 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.54 -47.15 13.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.454 -0.339 . . . . 72.25 111.724 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.92 -30.97 70.52 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.015 0.376 . . . . 74.22 112.015 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -52.21 -36.84 53.25 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.835 0.35 . . . . 75.11 111.195 174.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.68 -29.56 64.4 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.082 -0.508 . . . . 41.3 113.167 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.467 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 63.2 mtm -90.62 -43.88 9.89 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 122.412 -0.463 . . . . 75.55 111.658 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HG22 ' A' ' 105' ' ' VAL . 8.2 mp -58.87 -32.98 69.97 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.348 0.499 . . . . 75.03 112.348 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -60.96 -12.61 11.89 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.645 0.609 . . . . 74.11 112.645 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.21 5.98 9.15 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.522 0.564 . . . . 72.11 112.522 179.089 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 62' ' ' MET . 79.3 mt -88.73 -83.47 0.22 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.319 0.489 . . . . 51.45 112.319 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 49.56 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.488 0.661 . . . . 63.34 112.529 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -82.37 120.4 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.692 -0.686 . . . . 52.2 111.239 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.2 -14.39 15.86 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.234 0.457 . . . . 72.22 112.234 178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -164.93 178.72 6.92 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.308 0.575 . . . . 74.41 112.282 173.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -48.8 -40.48 29.29 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.288 0.847 . . . . 73.12 113.288 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -58.31 -35.41 71.8 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 111.769 0.285 . . . . 74.2 111.769 -175.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.548 ' HB2' HG23 ' A' ' 68' ' ' ILE . 25.3 m-20 -67.8 -41.38 83.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.249 0.547 . . . . 65.13 110.627 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 87.8 t -56.01 -42.95 73.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 115.892 -0.595 . . . . 73.22 111.019 177.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.04 -31.47 72.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.912 -0.586 . . . . 74.43 111.525 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 t -64.86 -37.49 87.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.13 0.49 . . . . 74.23 110.675 176.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.406 ' O ' ' HG2' ' A' ' 81' ' ' MET . 90.3 mt -59.83 -31.94 70.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.231 -0.441 . . . . 73.41 111.268 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.2 t -57.8 -36.77 72.67 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.109 0.48 . . . . 61.2 111.173 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -64.3 -40.98 97.04 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.267 -0.424 . . . . 73.13 110.656 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.01 -43.89 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 120.947 0.403 . . . . 71.41 110.527 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.478 ' HB2' HG21 ' A' ' 128' ' ' VAL . 20.0 mmt -55.49 -38.67 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.201 0.524 . . . . 45.04 111.233 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 74.6 mt -61.06 -41.56 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.024 -0.535 . . . . 74.41 111.18 175.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -66.05 -28.55 68.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.511 -0.313 . . . . 74.04 111.533 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 86.8 t -61.65 -35.65 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 111.777 0.288 . . . . 71.22 111.777 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.579 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 20.7 m-85 -91.6 28.69 1.67 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.414 0.524 . . . . 75.23 112.414 179.197 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.0 t -58.25 -36.77 73.72 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.572 0.582 . . . . 73.25 112.572 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -87.16 170.18 11.71 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.181 0.515 . . . . 63.45 112.115 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -113.29 -1.49 24.93 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.186 -0.461 . . . . 54.02 113.638 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.503 HG23 ' HD2' ' A' ' 94' ' ' ARG . 24.9 m -60.04 138.11 21.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-N 117.219 0.509 . . . . 74.23 111.97 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 51.2 p -84.94 35.62 0.58 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.596 0.591 . . . . 64.4 112.596 -172.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.53 108.45 17.31 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.119 -0.363 . . . . 71.43 111.227 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.477 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.7 m95 -57.35 -19.58 23.65 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.403 0.52 . . . . 72.2 112.403 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.73 -25.99 45.46 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.993 -0.622 . . . . 32.54 112.654 174.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.503 ' HD2' HG23 ' A' ' 89' ' ' VAL . 71.0 mtp180 -67.24 -40.22 86.3 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.064 0.459 . . . . 74.05 110.531 175.191 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.404 HG13 ' CE3' ' A' ' 92' ' ' TRP . 40.4 mm -63.7 -43.31 98.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 116.074 -0.512 . . . . 75.0 110.062 174.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.8 t -58.85 -42.42 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.894 -0.594 . . . . 70.32 110.568 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.2 m -58.66 -43.77 89.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.938 0.399 . . . . 75.42 111.278 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.579 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 32.5 tp -61.46 -55.11 34.83 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.243 0.544 . . . . 63.44 111.593 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.0 mt -66.84 -40.68 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 116.13 -0.486 . . . . 55.53 111.717 -176.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 99.9 p -64.32 -44.05 92.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.63 -0.259 . . . . 64.31 111.172 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -60.8 -42.27 97.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.595 0.236 . . . . 74.23 110.994 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.66 90.41 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 120.727 -0.749 . . . . 65.24 112.193 174.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.79 -29.53 69.5 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.105 0.478 . . . . 73.13 111.597 176.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -68.17 -47.26 68.47 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.256 -0.429 . . . . 74.34 110.647 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.417 HG22 HD11 ' A' ' 63' ' ' LEU . 53.8 t -64.89 -35.9 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.428 -0.351 . . . . 63.11 110.43 175.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.87 -43.12 69.31 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.176 -0.466 . . . . 71.01 111.453 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.429 ' NZ ' ' OE1' ' A' ' 52' ' ' GLN . 52.7 mttp -57.09 -45.92 82.97 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.265 0.555 . . . . 72.5 110.721 174.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.402 ' O ' HG12 ' A' ' 112' ' ' ILE . 78.4 t60 -64.04 -33.63 76.17 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.938 -0.574 . . . . 72.41 111.307 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.34 -49.92 67.55 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.567 -0.288 . . . . 63.0 111.108 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -58.08 -38.42 76.37 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.981 0.419 . . . . 72.33 110.796 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.2 m -57.54 -35.04 69.78 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.055 -0.52 . . . . 71.44 111.531 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.9 pt -106.32 31.86 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 120.96 0.41 . . . . 71.55 111.149 176.204 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.8 p30 48.94 21.73 0.49 Allowed 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.959 1.096 . . . . 75.24 113.959 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -90.62 35.88 0.89 Allowed 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.998 -0.439 . . . . 63.21 111.371 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -44.91 69.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.9 0.333 . . . . 71.25 111.9 -177.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.4 m -57.28 -27.89 62.52 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.075 0.398 . . . . 73.12 112.075 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.6 m -65.41 -25.82 67.71 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.882 0.373 . . . . 71.11 111.835 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -53.95 -40.76 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.628 0.603 . . . . 75.41 112.628 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.57 -52.56 26.48 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.379 0.511 . . . . 73.31 112.379 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -59.15 -24.97 76.27 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 121.704 1.602 . . . . 53.52 112.308 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.58 -46.64 68.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.69 -0.485 . . . . 70.04 109.69 173.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.6 -39.21 79.75 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.291 -0.413 . . . . 72.51 111.174 174.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -57.33 -44.92 84.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.38 -0.373 . . . . 74.44 110.706 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 58.8 m -62.37 -45.13 94.56 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.373 -0.376 . . . . 73.24 111.572 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.432 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.9 mm -54.11 -53.35 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-O 121.44 0.638 . . . . 63.23 110.836 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' THR . . . . . 0.408 HG21 ' HB2' ' A' ' 10' ' ' LEU . 41.1 m -67.4 -36.39 81.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.521 -0.763 . . . . 61.34 111.704 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.7 t70 -59.93 -51.45 69.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.801 0.334 . . . . 43.3 110.598 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 81' ' ' MET . 57.8 t -64.95 -41.87 93.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.049 0.452 . . . . 73.45 111.122 177.035 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.511 ' HG ' HD11 ' A' ' 137' ' ' LEU . 52.3 tp -54.41 -53.14 58.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.067 -0.515 . . . . 62.54 111.462 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.506 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 94.9 t -73.52 -33.1 38.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.187 -0.46 . . . . 74.35 111.415 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 24.9 tpt180 -48.58 -46.71 39.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.842 0.457 . . . . 74.12 111.917 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -114.13 -28.56 7.27 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.739 1.014 . . . . 64.34 113.739 -175.807 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.594 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.5 mptp? -109.5 20.46 18.16 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.409 0.892 . . . . 64.13 113.409 -177.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 18.7 ttt180 -52.8 -53.91 41.6 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.261 0.467 . . . . 70.33 112.261 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -68.27 -40.0 82.01 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 111.866 0.321 . . . . 72.03 111.866 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -60.54 -41.39 94.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.631 0.253 . . . . 73.52 111.601 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.0 mt -54.84 -55.5 29.68 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.554 -0.294 . . . . 72.1 111.756 178.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -68.85 -41.12 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 112.218 0.451 . . . . 71.35 112.218 -178.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 66.5 mmtt -64.4 -39.36 93.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.52 0.563 . . . . 63.43 112.52 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -98.26 8.31 45.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.939 0.4 . . . . 74.52 111.411 178.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 45.0 mtt180 60.41 22.73 12.3 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.012 -0.54 . . . . 70.35 112.184 178.236 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLY . . . . . 0.477 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 20.82 -82.23 0.0 OUTLIER Glycine 0 C--N 1.34 0.8 0 N-CA-C 116.177 1.231 . . . . 72.2 116.177 176.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.425 ' O ' HG23 ' A' ' 147' ' ' VAL . 37.4 m95 -74.87 -41.8 59.12 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.815 0.302 . . . . 71.43 111.815 -172.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 9.8 m-20 -62.66 -46.21 89.27 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.468 . . . . 73.22 110.08 174.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.99 -31.1 77.07 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.969 -0.559 . . . . 73.52 112.537 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -59.55 -51.74 68.56 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.099 0.559 . . . . 74.02 110.976 176.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.6 t -59.65 -39.24 79.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 115.813 -0.631 . . . . 74.3 111.514 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' GLU . . . . . 0.628 ' HB3' ' HA2' ' A' ' 157' ' ' GLY . 52.6 mt-10 -73.49 -35.66 65.69 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.238 0.459 . . . . 73.12 112.238 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -62.86 -49.04 76.45 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.925 0.393 . . . . 65.45 111.473 -177.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -82.95 -16.15 48.48 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.452 -0.34 . . . . 73.01 111.237 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 83.1 t60 61.33 78.76 0.27 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.493 0.664 . . . . 72.43 112.017 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.54 HG21 HG23 ' A' ' 43' ' ' THR . 69.3 t -118.45 -72.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 115.888 -0.596 . . . . 73.35 111.737 -178.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.26 26.77 9.84 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.392 0.615 . . . . 73.41 110.356 -176.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -88.17 166.39 14.41 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 74.12 111.86 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 156' ' ' GLU . 0.0 OUTLIER -110.77 -10.32 14.46 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.066 0.395 . . . . 74.31 112.066 177.556 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 155' ' ' LEU . 12.0 pt-20 -134.32 -58.31 0.84 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.375 0.509 . . . . 73.2 112.375 -177.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' GLY . . . . . 0.628 ' HA2' ' HB3' ' A' ' 148' ' ' GLU . . . 54.5 -117.93 8.67 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 121.24 -0.505 . . . . 75.41 113.717 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.58 164.7 31.81 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.438 -0.411 . . . . 51.12 113.311 179.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -145.08 169.11 18.77 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 122.638 -0.331 . . . . 73.41 110.565 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 70.62 21.17 5.49 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.116 0.484 . . . . 64.43 111.428 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.32 -32.51 74.14 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.296 0.57 . . . . 72.44 110.216 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 52.5 m-70 -117.22 109.55 17.03 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.753 -0.658 . . . . 71.31 110.09 171.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -61.77 120.59 10.98 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.599 0.592 . . . . 72.33 112.599 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 21.9 m80 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.844 -0.598 . . . . 73.41 110.609 172.448 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 120.589 0.233 . . . . 71.140000000000001 110.394 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -57.28 -45.83 83.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.3 0.571 . . . . 63.420000000000002 110.843 175.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 69.5 tp -59.84 -38.88 83.32 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.716 -0.675 . . . . 71.420000000000002 111.089 175.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.25 -44.55 91.46 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.112 -0.494 . . . . 63.119999999999997 110.941 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mmm180 -63.49 -43.62 96.73 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.004 0.372 . . . . 74.329999999999998 112.004 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.43 ' O ' HG13 ' A' ' 12' ' ' ILE . 50.5 tt0 -60.62 -52.36 65.48 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.906 0.384 . . . . 75.319999999999993 111.35 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 p -61.6 -44.3 97.26 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.316 -0.402 . . . . 72.409999999999997 111.2 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.0 tp -54.83 -44.89 74.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.082 -0.508 . . . . 73.439999999999998 111.62 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 9.9 tp10 -61.95 -49.85 74.48 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.797 0.332 . . . . 74.5 111.166 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 8' ' ' GLN . 66.6 mt -54.84 -52.68 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.228 0.537 . . . . 74.430000000000007 111.106 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 99' ' ' ILE . 81.5 mt -64.78 -41.42 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.723 -0.671 . . . . 74.409999999999997 111.392 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -56.49 -46.29 80.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.339 -0.391 . . . . 63.420000000000002 111.418 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 62.5 mtp180 -61.89 -53.89 49.52 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.455 -0.339 . . . . 75.120000000000005 111.159 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.65 -42.02 67.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.821 0.343 . . . . 75.439999999999998 111.859 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.486 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.5 mp -65.69 -42.53 91.13 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.973 0.36 . . . . 71.120000000000005 111.973 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -66.84 -40.16 87.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 122.2 -0.312 . . . . 71.310000000000002 111.594 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 45.6 mt-10 -61.73 -50.61 71.71 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.108 0.48 . . . . 51.340000000000003 111.026 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.431 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 27.3 mm-40 -59.66 -40.01 86.33 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.206 -0.452 . . . . 64.120000000000005 111.714 176.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -64.62 -42.55 95.43 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.035 0.445 . . . . 74.019999999999996 111.847 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' HE2' ' A' ' 110' ' ' LYS . 69.4 p -87.49 -7.25 57.84 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.253 -0.43 . . . . 71.140000000000001 112.039 -176.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 C-N-CA 121.193 -0.527 . . . . 72.430000000000007 113.379 178.534 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.919 0 N-CA-C 114.28 0.472 . . . . 71.219999999999999 114.28 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.04 -49.95 14.19 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 122.615 -0.344 . . . . 72.209999999999994 111.855 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.8 m -55.15 -48.27 73.95 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.152 0.427 . . . . 65.319999999999993 112.152 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 61.2 m -68.01 -34.67 76.95 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.701 0.286 . . . . 73.200000000000003 111.503 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -63.58 -54.92 28.45 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.733 0.301 . . . . 61.340000000000003 111.449 176.314 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 18.5 ptmt -63.39 -36.85 85.1 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.844 0.355 . . . . 72.329999999999998 111.144 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.464 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -62.99 -46.79 86.04 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.656 0.265 . . . . 63.229999999999997 111.424 176.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.3 tp -61.06 -50.65 72.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.255 0.465 . . . . 74.519999999999996 112.255 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.8 pt-20 -64.8 -35.89 82.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 122.136 -0.353 . . . . 65.25 111.675 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.591 ' O ' HG22 ' A' ' 47' ' ' VAL . 53.6 m -65.96 -47.32 75.02 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.713 0.292 . . . . 72.140000000000001 110.695 174.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.3 mt -53.95 -49.43 68.73 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.229 0.455 . . . . 72.420000000000002 112.229 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 45' ' ' ARG . 10.7 ptm180 -66.43 -41.62 88.92 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.116 0.413 . . . . 65.010000000000005 112.116 -176.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -70.32 -42.99 71.23 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.152 0.427 . . . . 73.230000000000004 112.152 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 43' ' ' THR . 25.4 m -82.78 -33.48 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 122.035 -0.416 . . . . 74.329999999999998 111.427 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -62.11 -40.8 99.42 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.453 -0.403 . . . . 63.310000000000002 112.675 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 17.4 t70 -55.82 -47.69 76.75 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.971 0.415 . . . . 53.329999999999998 110.921 174.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.05 -44.21 96.44 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.972 -0.632 . . . . 75.209999999999994 112.63 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.5 t -57.89 -44.36 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-O 120.742 0.306 . . . . 74.310000000000002 111.063 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 76.8 mt-30 -60.33 -42.65 96.09 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.598 -0.273 . . . . 65.510000000000005 111.373 176.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.1 mmm180 -55.2 -52.66 62.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 111.975 0.361 . . . . 74.420000000000002 111.975 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -75.33 -33.21 61.11 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.16 0.43 . . . . 71.219999999999999 112.16 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -90.91 -17.62 26.13 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.765 1.024 . . . . 74.129999999999995 113.765 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -48.72 -50.25 34.39 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 118.163 0.438 . . . . 74.340000000000003 112.163 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.2 t -55.92 -31.09 62.59 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.046 0.388 . . . . 71.319999999999993 112.046 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.63 -48.61 11.52 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.38 -0.373 . . . . 52.25 111.692 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -58.55 -47.12 85.3 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.487 -0.324 . . . . 72.439999999999998 111.703 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -52.38 -30.4 28.81 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.877 0.37 . . . . 75.340000000000003 111.758 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.16 -39.99 95.16 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.285 -0.483 . . . . 51.219999999999999 113.017 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.0 mtm -90.6 -34.71 15.37 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.269 0.557 . . . . 71.420000000000002 110.575 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -58.56 -36.87 74.6 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.955 -0.566 . . . . 71.120000000000005 111.596 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -60.11 -39.43 86.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.222 -0.445 . . . . 71.430000000000007 111.849 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 -9.78 43.03 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 111.814 0.301 . . . . 75.430000000000007 111.814 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.1 mt -82.2 -76.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.656 0.265 . . . . 75.349999999999994 110.61 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 47.21 91.89 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.527 0.731 . . . . 74.510000000000005 112.321 -178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -76.68 110.12 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.243 0.545 . . . . 70.310000000000002 112.019 -175.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.414 ' HD2' ' ND2' ' A' ' 70' ' ' ASN . 0.6 OUTLIER -102.16 -6.92 22.68 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.037 -0.528 . . . . 75.140000000000001 112.094 178.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.414 ' ND2' ' HD2' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.12 169.73 15.82 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.748 0.309 . . . . 73.040000000000006 111.521 173.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -54.31 -32.09 55.65 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.546 0.573 . . . . 63.219999999999999 112.546 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.35 -35.14 67.3 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.869 0.366 . . . . 73.040000000000006 111.729 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.3 m-20 -68.92 -35.52 76.92 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.02 0.438 . . . . 70.019999999999996 110.454 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.84 -41.1 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.218 0.532 . . . . 54.200000000000003 110.519 175.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -59.07 -32.16 69.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.034 -0.53 . . . . 64.109999999999999 110.856 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -72.13 -40.26 68.23 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.144 -0.48 . . . . 64.099999999999994 110.801 174.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.1 mt -56.49 -33.68 66.21 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.558 -0.292 . . . . 74.099999999999994 111.007 176.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.432 ' O ' HG13 ' A' ' 82' ' ' ILE . 28.8 t -51.75 -42.18 62.14 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.299 -0.41 . . . . 74.530000000000001 111.494 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.93 -43.04 99.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.896 0.379 . . . . 72.5 111.063 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 84' ' ' VAL . 79.8 t -63.52 -44.19 98.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 120.948 0.404 . . . . 65.25 110.745 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -55.73 -39.23 70.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.975 -0.557 . . . . 75.219999999999999 111.625 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 78' ' ' SER . 76.5 mt -62.11 -44.36 98.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-O 121.175 0.512 . . . . 71.150000000000006 111.165 175.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -65.0 -27.9 69.14 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.395 -0.366 . . . . 60.149999999999999 111.955 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 80' ' ' VAL . 66.8 t -58.66 -20.99 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.807 0.337 . . . . 61.119999999999997 111.672 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 37.7 m-85 . . . . . 0 N--CA 1.472 0.635 0 N-CA-C 112.352 0.501 . . . . 74.030000000000001 112.352 177.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.472 ' CE3' HG13 ' A' ' 95' ' ' ILE . 96.8 m95 . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 120.837 0.351 . . . . 72.329999999999998 111.234 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.03 -28.5 61.11 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 121.244 -0.503 . . . . 72.019999999999996 112.893 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -70.17 -34.53 73.1 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.547 -0.384 . . . . 72.319999999999993 111.173 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.472 HG13 ' CE3' ' A' ' 92' ' ' TRP . 29.0 mm -58.13 -45.98 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.601 0.715 . . . . 74.549999999999997 109.437 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.76 -44.72 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 115.248 -0.887 . . . . 64.549999999999997 111.085 174.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.5 m -61.43 -35.71 78.32 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.292 -0.413 . . . . 62.329999999999998 111.344 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.502 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 22.8 tp -62.77 -55.31 27.68 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.34 0.59 . . . . 72.140000000000001 110.952 176.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 56.3 mt -67.11 -35.24 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.862 -0.608 . . . . 44.210000000000001 111.377 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.0 t -65.52 -47.08 77.17 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.004 -0.544 . . . . 53.25 111.19 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.3 t80 -62.99 -39.82 95.92 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.748 0.308 . . . . 63.240000000000002 110.593 176.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.7 -46.13 89.73 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.856 -0.688 . . . . 65.420000000000002 112.274 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.878 0.37 . . . . 74.310000000000002 111.547 176.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.13 -39.34 94.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.978 0.418 . . . . 75.439999999999998 111.017 178.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 101' ' ' PHE . 40.6 t -75.09 -38.97 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 120.941 0.4 . . . . 70.340000000000003 110.64 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.76 82.87 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.42 0.526 . . . . 75.109999999999999 112.42 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 18.3 ptpt -62.46 -34.89 77.71 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.76 0.314 . . . . 63.399999999999999 111.006 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.425 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -65.72 -37.69 87.11 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.853 0.358 . . . . 71.040000000000006 110.505 173.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.533 HD21 ' HB ' ' A' ' 68' ' ' ILE . 87.6 mt -61.78 -50.28 72.97 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.367 -0.379 . . . . 75.230000000000004 111.609 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 66.4 tttp -63.02 -35.64 80.91 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.994 -0.441 . . . . 74.219999999999999 110.79 177.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 85.0 m -56.19 -41.67 75.91 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.928 0.394 . . . . 74.5 110.846 175.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.5 pt -97.97 20.4 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 112.08 0.4 . . . . 74.329999999999998 112.08 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 71.78 3.45 4.67 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.561 0.948 . . . . 72.519999999999996 113.561 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -84.82 45.55 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.601 0.593 . . . . 61.240000000000002 112.601 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.58 -34.25 76.6 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.117 0.414 . . . . 74.219999999999999 112.117 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.4 m -58.88 -26.52 64.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.821 0.343 . . . . 73.200000000000003 111.49 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -77.83 -27.52 49.96 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.551 -0.295 . . . . 72.400000000000006 111.714 178.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.7 mt -57.68 -46.27 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.622 0.601 . . . . 63.539999999999999 112.622 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.84 -52.05 44.11 Favored Pre-proline 0 CA--C 1.55 0.943 0 N-CA-C 112.577 0.584 . . . . 74.200000000000003 112.577 -174.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.15 -27.45 84.91 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.802 1.668 . . . . 74.430000000000007 112.134 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -64.71 -48.0 76.26 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.711 -0.477 . . . . 72.219999999999999 109.711 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.486 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.04 -39.97 72.8 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.001 0.429 . . . . 72.319999999999993 111.031 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.09 -36.89 85.51 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.214 -0.448 . . . . 73.109999999999999 111.061 174.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -64.42 -43.18 95.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 120.79 0.329 . . . . 74.340000000000003 111.209 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.3 mm -56.52 -52.92 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.27 0.557 . . . . 71.299999999999997 110.57 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 m -64.54 -35.17 80.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.76 -0.654 . . . . 65.230000000000004 111.39 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 13.7 t70 -60.33 -52.74 63.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.37 -0.377 . . . . 74.200000000000003 111.197 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.472 ' O ' HG22 ' A' ' 132' ' ' THR . 66.5 t -64.27 -42.04 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 121.027 0.441 . . . . 62.119999999999997 110.791 177.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.1 tp -54.27 -52.87 60.03 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.866 -0.607 . . . . 74.340000000000003 111.257 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 85.0 t -74.85 -23.85 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 115.958 -0.564 . . . . 74.319999999999993 111.85 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 48.7 ttm-85 -70.17 -46.79 63.91 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.092 0.404 . . . . 73.530000000000001 112.092 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 133' ' ' LYS . 8.0 t -108.26 -34.99 6.66 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.373 0.879 . . . . 75.299999999999997 113.373 -176.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HG2' HG23 ' A' ' 132' ' ' THR . 75.5 mmtt -99.39 18.66 17.18 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.938 -0.477 . . . . 75.209999999999994 112.017 -177.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 9.0 tpt180 -46.32 -61.71 1.67 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.101 0.56 . . . . 45.149999999999999 112.481 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -62.48 -41.41 98.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.927 -0.578 . . . . 73.140000000000001 111.985 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -59.55 -38.31 80.74 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.797 0.332 . . . . 54.140000000000001 111.509 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.7 mt -56.62 -51.15 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.395 -0.366 . . . . 73.329999999999998 111.919 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.7 p -78.16 -43.6 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 63.409999999999997 112.383 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -61.13 -50.5 72.97 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.216 0.451 . . . . 70.099999999999994 112.216 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -94.08 9.84 36.09 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.014 0.435 . . . . 74.040000000000006 111.057 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 143' ' ' TRP . 48.0 mtm180 58.89 25.58 13.84 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.74 -0.664 . . . . 75.109999999999999 111.745 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 24.53 -79.78 0.0 OUTLIER Glycine 0 N--CA 1.471 1.013 0 N-CA-C 115.562 0.985 . . . . 61.240000000000002 115.562 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 40' ' ' ALA . 31.4 m95 -70.83 -46.08 63.38 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.805 0.336 . . . . 70.340000000000003 111.678 -176.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 11.3 m-20 -61.78 -40.49 95.37 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.2 0.524 . . . . 74.230000000000004 110.218 175.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.99 -31.17 67.06 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.847 -0.615 . . . . 62.420000000000002 112.705 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -63.54 -46.37 86.31 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.108 0.563 . . . . 71.329999999999998 111.613 178.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.583 HG13 ' HB ' ' A' ' 152' ' ' VAL . 96.7 t -67.44 -36.26 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 112.33 0.493 . . . . 53.340000000000003 112.33 -178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -74.01 -38.04 64.21 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 122.204 -0.31 . . . . 71.340000000000003 111.157 176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.96 -48.14 83.2 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.824 0.345 . . . . 73.420000000000002 111.453 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -82.5 -1.59 50.9 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.058 0.392 . . . . 72.5 112.058 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.2 t60 56.65 72.48 0.5 Allowed 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.47 0.545 . . . . 73.510000000000005 112.47 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 147' ' ' VAL . 97.6 t . . . . . 0 N--CA 1.471 0.587 0 O-C-N 122.256 -0.278 . . . . 71.340000000000003 110.866 174.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 m-20 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 120.897 0.38 . . . . 73.420000000000002 111.597 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -65.21 -30.82 71.75 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.495 0.664 . . . . 63.530000000000001 109.262 171.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 137' ' ' LEU . 57.0 tp -55.37 -43.82 75.48 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.454 -0.794 . . . . 73.109999999999999 110.669 170.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 58.8 t80 -60.54 -47.51 85.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.541 -0.754 . . . . 74.120000000000005 111.314 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -71.36 -31.34 67.22 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.077 0.399 . . . . 72.530000000000001 112.077 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 41.0 tt0 -65.61 -53.34 43.03 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.169 0.509 . . . . 64.340000000000003 110.58 175.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 p -61.08 -42.47 98.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.808 -0.633 . . . . 53.219999999999999 110.961 178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 tp -55.33 -47.69 75.29 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.022 -0.536 . . . . 74.329999999999998 112.047 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.94 -41.46 91.29 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.798 0.332 . . . . 74.430000000000007 111.082 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLN . 81.6 mt -59.04 -54.14 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.108 0.48 . . . . 74.25 111.074 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' LEU . 80.8 mt -61.76 -44.95 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.02 -0.537 . . . . 74.239999999999995 111.235 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.3 t -54.83 -46.6 74.63 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.772 0.32 . . . . 71.420000000000002 111.365 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.549 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 9.9 mtp180 -57.96 -58.02 10.26 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.698 0.285 . . . . 64.010000000000005 110.963 175.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.409 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 59.2 t80 -53.68 -44.72 69.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.029 -0.532 . . . . 75.519999999999996 111.991 -174.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.0 mp -59.95 -45.98 90.91 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.539 -0.3 . . . . 74.510000000000005 111.556 177.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.447 ' HG3' HH11 ' A' ' 18' ' ' ARG . 39.5 mmm-85 -65.91 -43.88 86.87 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.777 0.323 . . . . 73.409999999999997 111.399 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.549 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 42.1 mt-10 -63.26 -41.95 99.09 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.892 0.377 . . . . 44.149999999999999 111.489 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -71.43 -40.62 70.29 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.8 0.333 . . . . 73.230000000000004 111.735 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.92 97.6 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.963 0.411 . . . . 74.109999999999999 111.723 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.9 p -89.04 -16.16 32.31 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.259 0.466 . . . . 52.299999999999997 112.259 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.9 0 C-N-CA 120.957 -0.639 . . . . 72.510000000000005 112.465 -176.444 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.861 0 N-CA-C 114.286 0.475 . . . . 65.219999999999999 114.286 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.578 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -60.43 -50.83 72.03 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.063 0.394 . . . . 55.109999999999999 112.063 -176.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.3 m -58.82 -38.82 79.51 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.98 0.419 . . . . 74.310000000000002 111.477 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.8 p -73.24 -39.07 65.76 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.535 -0.302 . . . . 53.32 111.505 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 11.9 ttt180 -59.54 -54.58 44.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.808 0.337 . . . . 74.519999999999996 111.265 174.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 22.5 mtpp -55.33 -41.59 72.65 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.055 -0.521 . . . . 64.299999999999997 110.894 -177.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.23 82.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.237 -0.438 . . . . 45.200000000000003 111.465 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.04 -53.12 60.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.126 0.417 . . . . 73.019999999999996 112.126 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -66.51 -21.37 66.17 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.173 -0.33 . . . . 72.219999999999999 111.829 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 47' ' ' VAL . 97.4 m -77.5 -42.31 36.14 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.807 0.337 . . . . 54.240000000000002 110.265 170.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.25 -40.79 71.35 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.375 -0.375 . . . . 72.519999999999996 111.72 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.409 ' HA ' ' HE1' ' A' ' 16' ' ' TYR . 5.7 ptm180 -72.65 -37.63 67.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.055 -0.403 . . . . 64.209999999999994 111.231 178.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -66.91 -44.89 79.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.993 0.425 . . . . 63.229999999999997 111.68 -178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 51' ' ' VAL . 18.7 m -90.94 -33.65 5.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 120.891 0.377 . . . . 75.209999999999994 111.533 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.25 -47.16 83.23 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 116.076 -0.511 . . . . 71.409999999999997 113.902 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 13.7 t70 -51.71 -53.31 40.67 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 117.472 0.636 . . . . 62.100000000000001 110.621 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.88 -46.48 90.49 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.994 -0.548 . . . . 64.409999999999997 113.112 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.0 t -57.62 -42.21 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 O-C-N 122.786 -0.244 . . . . 71.349999999999994 111.033 177.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.3 mt-30 -59.32 -53.39 58.78 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.586 -0.279 . . . . 73.120000000000005 110.982 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 9.0 mmm180 -58.33 -41.24 84.16 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.738 0.304 . . . . 73.099999999999994 111.756 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -71.42 -46.05 61.12 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.289 0.566 . . . . 72.129999999999995 111.685 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -80.16 -17.53 52.19 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.858 -0.61 . . . . 74.510000000000005 112.479 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 38.0 tt0 -48.18 -54.82 12.1 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.863 0.69 . . . . 73.439999999999998 112.863 -172.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.97 -31.55 67.0 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.902 0.382 . . . . 73.430000000000007 111.843 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.7 -36.24 60.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.842 0.353 . . . . 75.049999999999997 111.542 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -76.06 -31.76 58.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.947 0.351 . . . . 72.230000000000004 111.947 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -48.35 -39.58 22.56 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.855 0.36 . . . . 70.310000000000002 111.776 178.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.46 -37.95 61.61 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 116.052 -0.522 . . . . 74.549999999999997 113.761 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.474 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 56.9 mtm -90.45 -38.96 12.92 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.119 -0.636 . . . . 64.129999999999995 110.506 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.5 tp -54.49 -43.85 72.13 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.871 -0.604 . . . . 65.120000000000005 111.868 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -57.22 -30.18 64.37 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.811 0.671 . . . . 63.229999999999997 112.811 -177.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' A' ' 62' ' ' MET . 19.0 pttp -101.26 4.82 42.12 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.866 0.365 . . . . 50.039999999999999 111.854 -177.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.4 mt -99.94 -69.57 0.76 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.704 0.288 . . . . 75.510000000000005 110.868 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 71.7 -48.63 0.68 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.479 0.918 . . . . 72.519999999999996 113.479 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.442 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.6 mp 62.97 98.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.571 0.7 . . . . 74.25 111.476 -174.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -102.15 -9.56 20.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.863 -179.332 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -163.12 177.55 9.01 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.459 0.541 . . . . 62.32 112.459 175.374 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.58 -41.85 54.93 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.847 0.684 . . . . 74.439999999999998 112.847 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.78 -39.38 68.33 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.659 0.266 . . . . 63.109999999999999 111.309 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.92 -41.93 95.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.197 0.523 . . . . 74.140000000000001 110.836 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.8 t -57.59 -48.06 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.26 0.552 . . . . 61.439999999999998 110.939 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.7 -26.24 65.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.311 -0.404 . . . . 74.150000000000006 111.321 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.0 t -65.73 -39.34 91.04 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.064 0.459 . . . . 52.210000000000001 110.682 172.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 81' ' ' MET . 92.0 mt -59.14 -35.44 73.49 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.266 -0.425 . . . . 75.349999999999994 111.075 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.437 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.2 t -52.58 -40.43 62.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.916 0.388 . . . . 71.450000000000003 111.383 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -53.55 -35.97 61.33 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.287 -0.415 . . . . 72.120000000000005 111.46 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 58.2 t -82.72 -39.13 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.015 0.436 . . . . 75.120000000000005 111.183 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.454 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.4 mmt -54.37 -37.49 65.04 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.114 0.483 . . . . 71.409999999999997 111.366 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 78' ' ' SER . 74.7 mt -59.28 -40.03 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 116.22 -0.445 . . . . 42.32 111.518 175.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -66.62 -32.02 73.08 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 120.767 0.318 . . . . 74.340000000000003 111.474 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.3 t -57.39 -29.42 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-O 120.991 0.424 . . . . 74.239999999999995 111.542 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.463 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 25.2 m-85 . . . . . 0 N--CA 1.471 0.612 0 N-CA-C 112.727 0.639 . . . . 71.239999999999995 112.727 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 92.4 m95 . . . . . 0 CA--C 1.538 0.497 0 CA-C-O 120.948 0.404 . . . . 74.109999999999999 111.411 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.86 -24.74 50.66 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.078 -0.582 . . . . 71.310000000000002 112.763 173.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -64.46 -39.08 93.13 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.641 -0.329 . . . . 74.230000000000004 110.767 174.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.9 mm -59.35 -48.68 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.336 0.589 . . . . 74.120000000000005 110.118 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.45 -46.88 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 115.541 -0.754 . . . . 61.049999999999997 110.988 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.5 m -59.26 -48.81 80.21 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.328 -0.396 . . . . 73.25 111.655 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.505 ' HG ' HG23 ' A' ' 125' ' ' ILE . 33.0 tp -56.59 -54.53 44.9 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.221 0.534 . . . . 71.120000000000005 111.485 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 53.5 mt -67.74 -32.99 59.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 116.018 -0.537 . . . . 73.219999999999999 111.148 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.2 t -60.48 -51.7 68.35 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.257 -0.429 . . . . 75.129999999999995 111.291 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 105' ' ' VAL . 28.4 t80 -64.42 -37.76 88.64 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.604 -0.271 . . . . 75.349999999999994 110.782 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -48.99 78.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.872 -0.68 . . . . 43.340000000000003 112.572 175.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.442 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.62 -35.99 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.109 0.481 . . . . 64.439999999999998 111.259 176.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.562 ' CE2' HD22 ' A' ' 63' ' ' LEU . 47.4 t80 -62.46 -44.2 96.98 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.045 -0.525 . . . . 64.420000000000002 111.115 178.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 101' ' ' PHE . 55.9 t -66.87 -37.53 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 120.824 0.345 . . . . 52.439999999999998 110.471 175.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.66 -38.54 72.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.237 -0.438 . . . . 61.340000000000003 111.655 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.6 -45.05 93.06 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.104 0.478 . . . . 74.040000000000006 110.734 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.45 ' O ' HG12 ' A' ' 112' ' ' ILE . 82.4 t60 -64.6 -39.95 94.63 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.212 -0.449 . . . . 71.030000000000001 110.704 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.23 -49.26 78.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.358 -0.383 . . . . 71.420000000000002 111.564 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -59.99 -44.13 94.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.095 0.474 . . . . 54.240000000000002 110.466 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.8 m -56.7 -45.09 82.04 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.113 -0.494 . . . . 75.340000000000003 111.706 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 108' ' ' HIS . 35.7 pt -87.15 12.66 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-O 120.92 0.391 . . . . 71.230000000000004 111.773 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 67.99 16.58 9.56 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.041 0.756 . . . . 61.299999999999997 113.041 174.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -92.74 38.86 1.03 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.83 0.348 . . . . 73.319999999999993 110.942 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.24 -32.95 67.08 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.083 0.401 . . . . 61.049999999999997 112.083 -176.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.5 p -56.26 -38.34 71.03 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.847 0.356 . . . . 74.549999999999997 111.704 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.5 m -61.96 -26.74 68.38 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.68 0.622 . . . . 75.430000000000007 112.68 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 18' ' ' ARG . 65.8 mt -54.5 -45.36 70.57 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 112.874 0.694 . . . . 74.319999999999993 112.874 -176.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.32 -52.71 35.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 112.44 0.533 . . . . 54.229999999999997 112.44 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -26.11 81.66 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.75 1.633 . . . . 52.219999999999999 112.262 173.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.6 tt -66.16 -44.39 84.22 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.635 -0.505 . . . . 75.209999999999994 109.635 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.3 -37.67 75.54 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.219 -0.446 . . . . 70.450000000000003 110.896 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.05 -39.3 94.32 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.562 -0.29 . . . . 62.32 111.414 174.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.7 m -63.15 -45.71 90.63 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.016 0.436 . . . . 70.040000000000006 110.986 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.6 mm -56.58 -52.78 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.297 0.57 . . . . 62.310000000000002 110.794 175.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.6 m -65.91 -34.81 78.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.804 -0.635 . . . . 72.299999999999997 111.974 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 20.3 t70 -63.14 -50.27 71.08 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.458 -0.337 . . . . 71.519999999999996 110.53 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.7 t -63.05 -39.82 86.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.053 0.454 . . . . 51.200000000000003 111.084 176.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.53 ' HG ' HD11 ' A' ' 137' ' ' LEU . 60.1 tp -53.28 -53.12 55.44 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.185 0.517 . . . . 70.209999999999994 111.338 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.514 ' HA ' ' HB3' ' A' ' 134' ' ' ARG . 42.0 t -73.6 -31.15 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 CA-C-N 116.038 -0.528 . . . . 43.340000000000003 111.756 177.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.7 tpt180 -52.54 -42.42 64.4 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.212 0.605 . . . . 61.409999999999997 112.389 -176.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.697 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.6 t -126.16 -21.67 4.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.723 1.009 . . . . 75.439999999999998 113.723 -175.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 132' ' ' THR . 32.5 mmtp -122.67 13.27 10.01 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.293 0.849 . . . . 73.420000000000002 113.293 -173.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 0.2 OUTLIER -60.26 -40.46 90.43 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.537 0.684 . . . . 73.329999999999998 110.913 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 134' ' ' ARG . 33.0 t70 -59.44 -50.63 73.2 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.146 -0.934 . . . . 53.439999999999998 110.803 177.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -59.05 -36.83 75.71 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.739 0.304 . . . . 64.230000000000004 111.549 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.53 HD11 ' HG ' ' A' ' 129' ' ' LEU . 88.1 mt -57.91 -49.33 77.1 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.436 -0.347 . . . . 73.109999999999999 111.791 176.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.8 p -77.6 -31.98 17.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 112.041 0.386 . . . . 55.100000000000001 112.041 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.4 mmtt -64.34 -58.58 6.09 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.08 0.466 . . . . 74.439999999999998 111.813 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -91.73 -1.32 57.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.089 0.403 . . . . 73.510000000000005 112.089 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 59.84 80.83 0.19 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.248 0.547 . . . . 65.430000000000007 110.242 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -55.31 -50.75 58.34 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.474 -0.784 . . . . 71.109999999999999 114.352 -171.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.44 ' O ' HG23 ' A' ' 147' ' ' VAL . 26.1 m95 -73.84 -36.27 64.89 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 117.014 0.407 . . . . 71.239999999999995 111.903 -175.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.22 -51.67 65.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.487 0.661 . . . . 61.43 110.741 174.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.07 -31.66 78.44 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.486 -0.779 . . . . 51.109999999999999 113.101 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.89 -45.21 82.71 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.118 0.485 . . . . 71.120000000000005 111.288 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 143' ' ' TRP . 48.2 t -65.61 -46.01 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.96 -0.564 . . . . 61.539999999999999 112.168 -178.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -27.73 61.24 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.101 0.408 . . . . 71.0 112.101 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -57.3 -49.1 77.19 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.215 0.531 . . . . 72.319999999999993 110.953 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -83.66 -0.3 50.09 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.263 -0.426 . . . . 71.430000000000007 111.472 173.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 19.3 t60 60.17 37.73 20.58 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.335 0.654 . . . . 73.150000000000006 112.055 175.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 120.873 0.368 . . . . 71.120000000000005 110.922 179.571 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 4.0 p30 . . . . . 0 CA--C 1.543 0.709 0 CA-C-O 120.745 0.307 . . . . 54.399999999999999 111.209 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.42 -46.08 91.28 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.385 0.513 . . . . 72.239999999999995 112.385 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.584 HD23 ' HG3' ' A' ' 134' ' ' ARG . 65.0 tp -61.28 -42.74 99.16 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.08 0.467 . . . . 73.450000000000003 110.628 -179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -56.42 -45.29 80.78 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.764 -0.653 . . . . 72.409999999999997 111.037 174.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.529 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 25.3 mmm180 -66.71 -48.47 69.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.127 0.417 . . . . 75.409999999999997 112.127 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.416 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.6 tt0 -62.1 -51.4 68.06 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.063 0.459 . . . . 73.340000000000003 110.964 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.2 p -57.13 -37.74 72.44 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.04 0.447 . . . . 75.329999999999998 110.627 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.567 HD11 ' HG2' ' A' ' 123' ' ' GLU . 44.1 tp -60.09 -46.04 90.93 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.919 -0.582 . . . . 62.439999999999998 111.993 178.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.9 pt-20 -67.09 -40.76 87.01 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 120.452 -0.499 . . . . 71.109999999999999 110.939 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.44 ' N ' ' HG3' ' A' ' 11' ' ' GLU . 66.3 mt -57.21 -53.6 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.158 0.504 . . . . 72.25 110.964 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.468 HG23 HG23 ' A' ' 99' ' ' ILE . 84.3 mt -66.91 -45.69 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 115.852 -0.613 . . . . 61.009999999999998 111.502 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 27.7 t -56.52 -53.94 51.66 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.406 -0.361 . . . . 71.439999999999998 111.416 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.643 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 40.3 mtt180 -55.95 -49.75 72.67 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.305 -0.257 . . . . 74.439999999999998 110.305 176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.477 ' CD2' HG22 ' A' ' 99' ' ' ILE . 62.7 t80 -52.54 -44.91 66.09 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.994 0.368 . . . . 71.510000000000005 111.994 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.561 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.8 mp -60.66 -40.83 93.51 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.371 -0.205 . . . . 74.430000000000007 111.21 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 31.3 mmm-85 -64.63 -42.41 95.51 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.952 0.406 . . . . 70.129999999999995 110.876 177.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 4.7 mm-40 -56.66 -49.94 73.55 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.594 0.712 . . . . 64.129999999999995 110.881 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -75.43 -30.8 60.15 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.702 -0.681 . . . . 73.120000000000005 112.463 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -38.14 73.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.021 0.439 . . . . 65.140000000000001 111.637 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.3 p -87.69 -36.97 17.1 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.233 -0.439 . . . . 73.319999999999993 111.231 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.924 0 CA-C-N 116.28 -0.418 . . . . 71.0 112.517 -176.915 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.588 0 N-CA-C 113.487 0.155 . . . . 74.430000000000007 113.487 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.582 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -74.84 -52.21 11.97 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.405 0.521 . . . . 52.520000000000003 112.405 -174.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.1 m -59.13 -51.34 70.45 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 120.947 0.403 . . . . 71.400000000000006 111.443 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.7 m -60.48 -32.69 71.66 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.337 -0.392 . . . . 70.219999999999999 111.65 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -69.14 -48.64 61.83 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.017 0.436 . . . . 73.109999999999999 110.881 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 26.3 mtpp -56.59 -48.37 77.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.427 0.632 . . . . 70.420000000000002 110.667 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.71 77.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.758 -0.655 . . . . 73.420000000000002 111.9 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -54.8 -52.84 61.38 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.297 0.48 . . . . 70.040000000000006 112.297 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.41 -42.25 98.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.671 0.272 . . . . 61.25 111.366 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.494 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -63.95 -35.45 80.74 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.755 -0.202 . . . . 64.019999999999996 111.484 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 41.6 mt -53.91 -52.11 61.59 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.625 0.25 . . . . 74.319999999999993 111.673 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -77.24 -29.36 53.99 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.198 -0.314 . . . . 74.420000000000002 111.758 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.41 ' NH1' HG11 ' A' ' 152' ' ' VAL . 42.2 ttm180 -61.54 -44.45 97.02 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.421 -0.354 . . . . 72.030000000000001 111.56 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 43' ' ' THR . 22.3 m -93.78 -33.27 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.143 0.497 . . . . 73.019999999999996 111.135 176.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -56.82 -59.48 10.75 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.706 -0.679 . . . . 53.329999999999998 113.271 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.553 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 24.6 t70 -53.12 -34.01 54.86 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 117.322 0.561 . . . . 53.439999999999998 111.406 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.3 -49.33 75.45 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.216 -0.516 . . . . 44.32 112.598 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.62 -37.07 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-O 120.817 0.341 . . . . 72.409999999999997 111.464 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.8 mt-30 -56.92 -52.1 66.49 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.398 -0.365 . . . . 75.299999999999997 111.263 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 34.6 mmm-85 -62.09 -27.95 69.28 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.987 0.365 . . . . 64.030000000000001 111.987 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-20 -72.05 -41.95 66.84 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.373 0.606 . . . . 74.120000000000005 110.763 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -85.19 -15.67 42.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.499 -0.773 . . . . 52.439999999999998 112.582 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 52' ' ' GLN . 43.3 tt0 -47.32 -44.98 24.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.305 0.642 . . . . 74.209999999999994 112.717 -170.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.6 t -55.55 -42.56 74.81 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.952 0.406 . . . . 62.130000000000003 111.737 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.86 -48.28 32.25 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.795 0.331 . . . . 51.009999999999998 111.794 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -57.49 -44.11 84.69 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.559 -0.291 . . . . 72.120000000000005 111.749 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -55.01 -39.65 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.121 0.486 . . . . 75.409999999999997 110.835 174.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -63.77 -28.74 73.07 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-N 116.055 -0.521 . . . . 55.009999999999998 112.787 176.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 82.7 mtp -79.09 -47.98 15.15 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.094 0.473 . . . . 74.209999999999994 110.687 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.63 -34.84 73.3 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.294 0.479 . . . . 72.409999999999997 112.294 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.0 ptt180 -67.79 -16.7 64.24 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 111.968 0.359 . . . . 62.409999999999997 111.968 -178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 11.27 22.49 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.087 0.47 . . . . 71.450000000000003 111.161 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 -73.66 0.64 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.026 -0.534 . . . . 63.530000000000001 111.221 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 70.45 -43.86 0.56 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 113.766 1.024 . . . . 73.120000000000005 113.766 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.5 mp 62.83 90.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.445 0.64 . . . . 64.150000000000006 111.026 -174.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -12.6 33.13 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.975 -0.557 . . . . 75.420000000000002 111.935 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.23 175.28 13.61 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.359 0.599 . . . . 73.120000000000005 112.274 176.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.08 -35.26 69.17 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.678 -0.692 . . . . 63.409999999999997 112.71 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -62.58 -29.2 70.42 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.279 0.474 . . . . 75.219999999999999 112.279 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -66.68 -41.45 88.08 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.076 0.465 . . . . 62.549999999999997 110.144 174.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.3 t -57.37 -39.95 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.017 -0.538 . . . . 64.230000000000004 110.525 174.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -59.17 -42.05 89.88 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.168 0.509 . . . . 63.119999999999997 110.628 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.5 t -67.8 -35.83 79.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.028 -0.533 . . . . 72.400000000000006 111.745 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -55.78 -30.63 61.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.658 0.266 . . . . 74.019999999999996 111.523 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 82' ' ' ILE . 22.6 t -52.94 -37.41 60.95 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.009 0.433 . . . . 74.120000000000005 111.131 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -59.69 -49.11 79.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.112 0.482 . . . . 70.120000000000005 111.104 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.28 -41.46 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.97 -0.559 . . . . 65.439999999999998 110.996 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.403 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.4 mmt -58.04 -37.78 75.02 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.951 -0.568 . . . . 63.350000000000001 111.464 178.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' SER . 80.1 mt -63.42 -38.12 81.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 120.845 0.355 . . . . 72.319999999999993 111.045 173.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -62.23 -33.42 74.55 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.669 0.271 . . . . 73.530000000000001 111.613 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.534 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 95.7 t -56.27 -34.64 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-O 120.988 0.423 . . . . 74.209999999999994 111.442 177.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 74.2 m-85 . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 112.563 0.579 . . . . 72.409999999999997 112.563 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.5 m95 . . . . . 0 CA--C 1.546 0.823 0 N-CA-C 113.182 0.808 . . . . 73.129999999999995 113.182 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.78 -37.76 70.5 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 121.189 -0.529 . . . . 74.040000000000006 113.061 177.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.534 ' HD3' ' O ' ' A' ' 84' ' ' VAL . 3.7 mmp_? -61.6 -36.78 81.66 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.77 0.319 . . . . 71.230000000000004 111.781 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.01 -44.89 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.121 0.486 . . . . 74.030000000000001 110.723 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -58.41 -49.64 81.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.037 -0.529 . . . . 74.219999999999999 111.055 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.4 m -57.05 -47.66 80.42 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.796 0.331 . . . . 71.409999999999997 111.49 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.492 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 31.6 tp -58.65 -55.77 30.85 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.193 0.52 . . . . 62.439999999999998 112.068 -178.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.477 HG22 ' CD2' ' A' ' 16' ' ' TYR . 41.4 mt -70.46 -34.82 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 116.188 -0.46 . . . . 71.430000000000007 111.587 -174.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.5 m -66.54 -41.9 88.01 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.764 -0.198 . . . . 73.439999999999998 111.38 177.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.437 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.7 t80 -62.16 -43.8 98.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.705 0.288 . . . . 63.32 110.691 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.98 -45.57 86.47 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.891 -0.671 . . . . 70.129999999999995 112.375 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.549 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.83 -33.78 76.36 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.844 0.354 . . . . 73.209999999999994 111.816 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -65.61 -43.27 90.09 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.96 0.41 . . . . 71.209999999999994 110.54 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 101' ' ' PHE . 48.9 t -65.91 -38.47 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-O 120.851 0.358 . . . . 65.120000000000005 110.439 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.63 -41.2 69.76 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.185 -0.462 . . . . 64.209999999999994 111.865 177.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -54.34 -48.91 70.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.528 0.68 . . . . 71.319999999999993 110.619 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.471 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.4 t60 -67.05 -39.71 86.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.76 -0.655 . . . . 74.219999999999999 111.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -58.65 -50.14 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.737 0.303 . . . . 65.409999999999997 111.331 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.57 -45.95 90.33 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.084 0.469 . . . . 72.129999999999995 111.035 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 63.2 m -55.68 -40.23 72.02 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.937 -0.574 . . . . 43.140000000000001 112.231 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.4 pt -96.57 21.2 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.507 0.558 . . . . 64.209999999999994 112.507 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 69.16 10.43 7.84 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.832 0.679 . . . . 65.200000000000003 112.832 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -92.12 27.45 2.17 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.024 0.44 . . . . 73.219999999999999 110.589 175.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.514 ' HG3' HD12 ' A' ' 118' ' ' ILE . 70.8 tt0 -58.93 -34.86 72.21 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.342 0.497 . . . . 72.150000000000006 112.342 -174.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.9 m -56.92 -31.98 65.47 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.927 0.394 . . . . 75.519999999999996 111.195 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -64.74 -26.37 68.33 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.396 0.517 . . . . 72.140000000000001 112.396 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.514 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.0 mt -53.67 -41.22 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 112.725 0.639 . . . . 72.540000000000006 112.725 -176.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.04 -54.64 9.44 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 112.403 0.519 . . . . 74.239999999999995 112.403 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.13 -29.34 86.93 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 121.712 1.608 . . . . 75.129999999999995 112.263 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.7 tt -65.01 -46.39 81.55 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.867 -0.42 . . . . 75.040000000000006 109.867 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.561 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.93 -40.78 77.01 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.206 -0.452 . . . . 74.129999999999995 110.819 173.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.567 ' HG2' HD11 ' A' ' 10' ' ' LEU . 42.1 mt-10 -63.98 -32.87 74.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.095 -0.502 . . . . 73.230000000000004 111.162 177.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.0 m -68.01 -38.64 82.84 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.59 0.234 . . . . 72.439999999999998 111.186 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -58.34 -53.27 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.227 0.537 . . . . 75.439999999999998 110.405 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 61.0 m -64.11 -35.15 79.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.838 -0.619 . . . . 64.439999999999998 111.203 176.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 23.3 t70 -59.97 -52.58 64.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.536 0.199 . . . . 72.209999999999994 111.536 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 96.3 t -63.65 -45.46 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.14 0.495 . . . . 63.450000000000003 110.651 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.553 ' HG ' HD11 ' A' ' 137' ' ' LEU . 46.4 tp -51.58 -52.13 49.83 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.785 -0.643 . . . . 75.540000000000006 111.079 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.543 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -69.36 -37.04 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.89 -0.595 . . . . 70.319999999999993 111.836 177.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.4 tpt180 -58.4 -35.89 72.71 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.17 -0.468 . . . . 72.030000000000001 112.151 -174.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.409 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.6 t -123.26 -16.74 6.82 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.365 0.876 . . . . 74.430000000000007 113.365 -177.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.409 ' HG2' HG23 ' A' ' 132' ' ' THR . 45.3 mmtm -132.39 16.49 4.48 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.965 1.098 . . . . 72.329999999999998 113.965 -172.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.584 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.7 ttp180 -60.33 -50.8 72.17 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.786 0.721 . . . . 75.150000000000006 111.304 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 30.7 t70 -55.64 -44.74 77.43 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.061 0.458 . . . . 75.019999999999996 110.653 177.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -63.34 -36.59 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.366 -0.379 . . . . 72.230000000000004 111.867 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.553 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.0 mt -57.0 -50.44 72.71 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.679 0.276 . . . . 72.439999999999998 111.275 174.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -77.8 -32.28 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 112.546 0.573 . . . . 74.329999999999998 112.546 -177.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.6 mmtt -72.36 -51.9 18.5 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.069 -0.395 . . . . 54.350000000000001 111.585 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -86.1 -9.33 56.89 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.467 -0.333 . . . . 73.409999999999997 111.762 -177.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mtt-85 61.61 60.16 1.69 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.403 0.621 . . . . 71.540000000000006 110.124 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -48.06 -49.62 23.62 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 115.1 -0.954 . . . . 53.219999999999999 115.354 -171.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -69.07 -43.19 75.08 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 117.428 0.614 . . . . 74.239999999999995 112.046 -174.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.5 -32.8 73.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.212 0.529 . . . . 64.540000000000006 110.83 174.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.52 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -74.3 -30.53 60.51 Favored Glycine 0 CA--C 1.525 0.66 0 CA-C-N 116.002 -0.544 . . . . 71.209999999999994 112.74 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -57.33 -42.94 82.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 71.420000000000002 111.133 177.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE3' ' A' ' 39' ' ' LYS . 30.8 t -68.03 -42.17 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 115.926 -0.579 . . . . 74.310000000000002 111.781 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.52 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.9 pt-20 -71.82 -32.1 67.23 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.655 0.264 . . . . 73.430000000000007 111.518 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.67 -49.36 78.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.853 0.359 . . . . 74.329999999999998 111.523 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -83.58 -1.8 54.64 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.819 0.303 . . . . 75.430000000000007 111.819 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 37.3 t60 59.66 21.91 10.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.741 0.416 . . . . 74.209999999999994 111.915 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.41 HG11 ' NH1' ' A' ' 46' ' ' ARG . 94.6 t . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 120.976 0.417 . . . . 63.109999999999999 112.089 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 CA--C 1.539 0.546 0 N-CA-C 113.349 0.87 . . . . 73.439999999999998 113.349 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -56.48 -44.45 80.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.336 -0.847 . . . . 73.430000000000007 110.702 173.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 137' ' ' LEU . 60.0 tp -54.69 -43.71 72.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.838 -0.619 . . . . 65.340000000000003 111.782 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -68.31 -50.4 53.72 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.813 0.34 . . . . 72.040000000000006 111.365 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -63.55 -37.84 88.83 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.096 0.406 . . . . 71.340000000000003 112.096 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -69.44 -52.25 28.52 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.425 -0.352 . . . . 74.329999999999998 111.189 178.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -59.44 -51.86 68.08 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.716 0.293 . . . . 74.530000000000001 111.285 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.3 -45.0 65.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.284 -0.416 . . . . 74.310000000000002 111.689 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.554 ' HG2' ' HD2' ' A' ' 15' ' ' ARG . 28.2 tt0 -62.79 -51.56 66.62 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.72 0.295 . . . . 64.450000000000003 111.228 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' GLN . 72.0 mt -55.24 -48.76 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.072 0.463 . . . . 63.329999999999998 111.444 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.475 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.9 mt -64.04 -50.27 77.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 116.117 -0.492 . . . . 73.310000000000002 111.571 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 28.7 t -53.62 -54.23 40.57 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.812 0.339 . . . . 64.430000000000007 111.769 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.554 ' HD2' ' HG2' ' A' ' 11' ' ' GLU . 55.0 mtp180 -58.06 -50.29 73.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.299 -0.409 . . . . 75.340000000000003 111.386 -178.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.64 -47.45 73.49 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.796 0.331 . . . . 70.340000000000003 111.444 177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 13' ' ' ILE . 8.3 mp -59.11 -45.45 90.87 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.781 0.289 . . . . 71.030000000000001 111.781 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.4 mmm180 -62.58 -53.06 60.22 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.652 0.263 . . . . 72.530000000000001 111.217 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.526 ' OE2' ' HD3' ' A' ' 45' ' ' ARG . 10.1 pt-20 -64.86 -35.02 79.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.832 0.349 . . . . 73.340000000000003 111.889 -178.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.553 ' HG2' ' HB1' ' A' ' 103' ' ' ALA . 8.1 tp-100 -69.5 -25.75 64.2 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.959 0.409 . . . . 73.200000000000003 111.121 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.71 -31.29 21.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.122 0.416 . . . . 71.329999999999998 112.122 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' ARG . 66.4 p -87.71 -37.75 16.41 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.191 0.441 . . . . 50.009999999999998 112.191 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.98 0 CA-C-N 116.216 -0.447 . . . . 65.25 112.379 -173.865 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.777 0 N-CA-C 113.701 0.241 . . . . 53.32 113.701 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.71 -50.36 60.67 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.572 0.582 . . . . 55.109999999999999 112.572 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.2 m -55.17 -51.62 65.92 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.125 0.417 . . . . 71.450000000000003 112.125 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.6 m -60.61 -42.44 96.81 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.921 0.341 . . . . 74.219999999999999 111.921 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.79 -42.08 96.86 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.046 0.451 . . . . 73.430000000000007 110.891 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -64.34 -43.64 93.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.892 -0.595 . . . . 70.200000000000003 111.408 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.51 -55.12 37.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.764 0.316 . . . . 71.010000000000005 111.538 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.2 tp -54.7 -41.68 70.57 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.204 0.526 . . . . 75.140000000000001 110.973 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -62.5 -47.14 85.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.818 -0.628 . . . . 72.510000000000005 111.479 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.577 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.2 m -61.87 -41.39 97.79 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.134 -0.484 . . . . 74.409999999999997 111.521 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.3 mt -53.6 -33.67 55.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.181 0.438 . . . . 71.010000000000005 112.181 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.526 ' HD3' ' OE2' ' A' ' 19' ' ' GLU . 42.7 mtm-85 -72.75 -55.29 6.98 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.855 0.317 . . . . 70.349999999999994 111.855 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -63.1 -37.19 86.23 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.819 0.674 . . . . 63.100000000000001 112.819 -176.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 43' ' ' THR . 15.5 m -91.96 -31.18 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 O-C-N 122.052 -0.405 . . . . 70.209999999999994 111.948 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.52 -43.78 85.32 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 121.291 -0.48 . . . . 42.229999999999997 114.061 -175.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -51.7 -53.5 38.52 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 117.0 0.4 . . . . 64.019999999999996 111.977 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.82 -46.74 74.98 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 121.105 -0.569 . . . . 70.430000000000007 112.864 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.6 t -58.46 -49.16 83.15 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 120.818 0.342 . . . . 53.240000000000002 111.117 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -57.12 -44.24 83.09 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.365 -0.38 . . . . 72.299999999999997 111.929 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -68.73 -51.07 45.37 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.331 0.493 . . . . 61.32 112.331 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -61.9 -36.81 82.43 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.412 0.625 . . . . 73.200000000000003 111.385 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.32 -16.67 57.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.501 -0.772 . . . . 74.329999999999998 112.988 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.32 -50.0 22.79 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.911 0.708 . . . . 72.120000000000005 112.911 -171.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.9 t -53.81 -40.43 66.36 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.859 0.361 . . . . 61.130000000000003 111.791 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.57 -41.33 60.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.724 0.297 . . . . 73.209999999999994 111.547 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -62.69 -47.58 83.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.402 -0.363 . . . . 65.120000000000005 111.535 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -53.11 -39.02 63.1 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.131 0.491 . . . . 72.030000000000001 110.993 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.53 -29.57 69.84 Favored Glycine 0 CA--C 1.528 0.845 0 CA-C-N 115.945 -0.571 . . . . 63.43 113.063 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 63.5 mtm -89.61 -42.11 11.59 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 122.379 -0.483 . . . . 73.439999999999998 111.596 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -55.09 -35.51 64.68 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.232 0.456 . . . . 70.209999999999994 112.232 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -63.56 -22.05 66.68 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 112.495 0.554 . . . . 74.040000000000006 112.495 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.426 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -108.2 10.58 27.86 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.424 0.631 . . . . 72.519999999999996 111.21 174.42 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 65' ' ' LYS . 91.6 mt -117.18 -76.18 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.775 -0.648 . . . . 62.039999999999999 110.274 175.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.9 t0 71.12 -40.72 0.48 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.287 1.035 . . . . 65.010000000000005 113.426 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.559 HD11 HD21 ' A' ' 77' ' ' LEU . 3.0 mp 60.42 94.25 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.975 0.91 . . . . 63.340000000000003 112.541 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.76 -10.1 17.66 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.201 -0.454 . . . . 74.340000000000003 111.165 176.631 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.478 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -158.73 169.58 24.07 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.39 -0.368 . . . . 72.150000000000006 111.252 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.52 -32.19 66.8 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.171 0.804 . . . . 73.140000000000001 113.171 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.21 -33.38 58.14 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.946 0.403 . . . . 74.510000000000005 111.722 177.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -71.46 -39.56 70.87 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.015 0.436 . . . . 70.299999999999997 110.458 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -58.67 -45.45 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.253 0.549 . . . . 74.150000000000006 110.805 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.59 -33.19 73.47 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.195 0.522 . . . . 61.229999999999997 111.077 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.6 m -69.21 -29.19 67.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.165 -0.47 . . . . 61.329999999999998 111.327 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 68' ' ' ILE . 94.0 mt -61.77 -35.39 77.99 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.78 0.324 . . . . 64.140000000000001 110.813 174.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -55.47 -39.2 70.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.064 0.459 . . . . 74.010000000000005 111.013 175.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -62.3 -41.55 98.61 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.238 -0.437 . . . . 73.430000000000007 110.706 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.434 ' O ' HG23 ' A' ' 84' ' ' VAL . 83.7 t -59.35 -43.51 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 120.928 0.394 . . . . 62.240000000000002 110.47 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.485 ' HB2' HG21 ' A' ' 128' ' ' VAL . 18.9 mmt -56.74 -43.61 80.89 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.994 -0.548 . . . . 75.099999999999994 111.16 177.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 69.6 mt -59.08 -34.5 53.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.183 0.516 . . . . 70.510000000000005 110.964 175.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -73.08 -32.24 64.88 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 116.199 -0.455 . . . . 43.100000000000001 111.366 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' VAL . 88.0 t -59.45 -38.38 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-O 120.903 0.383 . . . . 73.109999999999999 111.924 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.411 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 72.6 m-85 . . . . . 0 N--CA 1.47 0.552 0 N-CA-C 112.192 0.441 . . . . 65.430000000000007 112.192 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.461 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 71.8 m95 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 112.033 0.383 . . . . 71.129999999999995 112.033 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.34 82.55 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.252 -0.499 . . . . 31.129999999999999 112.905 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' A' ' 94' ' ' ARG . 25.4 mmt180 -70.91 -32.49 69.44 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.464 -0.433 . . . . 74.219999999999999 111.117 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.413 HG13 ' HE3' ' A' ' 92' ' ' TRP . 46.3 mm -62.21 -46.29 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.032 0.444 . . . . 72.239999999999995 110.546 174.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -57.41 -48.25 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 116.129 -0.487 . . . . 71.030000000000001 110.869 174.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.1 m -56.55 -43.27 79.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.247 -0.433 . . . . 73.430000000000007 111.654 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 33.5 tp -59.3 -55.23 37.51 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.211 0.529 . . . . 72.239999999999995 111.652 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.1 mt -68.84 -34.08 62.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.071 -0.513 . . . . 75.329999999999998 111.449 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -64.91 -45.17 86.99 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.466 -0.333 . . . . 72.519999999999996 111.409 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -62.16 -43.06 99.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.77 0.319 . . . . 75.25 110.651 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -46.45 92.03 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.872 -0.68 . . . . 14.220000000000001 112.417 175.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 20' ' ' GLN . . . -66.73 -31.95 72.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.076 0.465 . . . . 65.349999999999994 111.951 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.19 -48.44 70.65 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.833 0.349 . . . . 63.229999999999997 110.571 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.9 t -65.44 -36.48 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.884 0.373 . . . . 74.430000000000007 110.573 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.34 -43.75 67.95 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.065 -0.516 . . . . 74.219999999999999 111.728 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -54.57 -49.54 70.09 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.149 0.5 . . . . 71.099999999999994 110.771 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.476 ' O ' HG12 ' A' ' 112' ' ' ILE . 79.1 t60 -60.87 -40.19 92.03 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.037 -0.529 . . . . 74.409999999999997 111.36 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 88.2 mt -62.17 -50.46 71.76 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.715 0.293 . . . . 74.450000000000003 111.658 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.473 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.0 tttm -62.89 -33.53 75.49 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.201 0.524 . . . . 75.340000000000003 111.212 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.9 m -64.14 -45.38 88.77 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.196 -0.456 . . . . 72.329999999999998 111.721 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.512 HG13 ' HG2' ' A' ' 114' ' ' GLN . 47.2 pt -90.33 24.64 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 N-CA-C 112.674 0.62 . . . . 74.409999999999997 112.674 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 69.28 12.49 8.4 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.848 0.685 . . . . 72.049999999999997 112.848 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.512 ' HG2' HG13 ' A' ' 112' ' ' ILE . 13.6 mm100 -99.61 36.99 1.67 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.071 -0.393 . . . . 70.040000000000006 111.633 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.89 -32.81 69.84 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.794 0.331 . . . . 71.200000000000003 111.492 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.442 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 52.4 m -53.79 -41.42 67.22 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.93 0.395 . . . . 61.310000000000002 111.344 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.457 ' HB2' HD13 ' A' ' 109' ' ' LEU . 53.1 m -56.9 -27.41 60.68 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.844 0.683 . . . . 74.120000000000005 112.844 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 63.9 mt -57.77 -33.55 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 112.203 0.446 . . . . 43.439999999999998 112.203 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.79 -54.61 6.15 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 112.481 0.549 . . . . 72.400000000000006 112.481 -177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.442 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.5 Cg_endo -59.52 -26.38 81.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.518 1.479 . . . . 72.120000000000005 111.799 172.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.434 HD12 HD11 ' A' ' 109' ' ' LEU . 6.5 tt -66.19 -46.13 78.37 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.661 -0.496 . . . . 74.519999999999996 109.661 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.14 -44.58 87.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.252 -0.431 . . . . 75.109999999999999 110.802 174.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -58.82 -39.48 81.3 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.4 -0.364 . . . . 71.329999999999998 111.176 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -61.67 -41.83 98.09 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.918 0.39 . . . . 62.100000000000001 111.006 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 121' ' ' LEU . 39.7 mm -60.79 -54.1 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-O 121.126 0.489 . . . . 74.530000000000001 110.984 177.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.2 m -68.18 -33.64 74.82 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.104 -0.498 . . . . 72.209999999999994 112.084 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.8 t70 -61.03 -52.46 64.9 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.283 -0.261 . . . . 64.540000000000006 110.788 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 81' ' ' MET . 80.4 t -64.51 -39.3 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.141 0.496 . . . . 72.140000000000001 110.975 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.529 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -58.93 -53.49 57.8 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.012 -0.54 . . . . 72.430000000000007 111.68 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.408 HG13 ' HB2' ' A' ' 134' ' ' ARG . 89.8 t -76.34 -33.79 24.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 111.955 0.354 . . . . 65.219999999999999 111.955 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 17.1 tpp180 -53.14 -33.36 52.11 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.246 0.461 . . . . 73.340000000000003 112.246 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.49 -28.75 2.04 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.679 0.992 . . . . 65.409999999999997 113.679 -175.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -104.31 9.4 35.93 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 112.757 0.651 . . . . 73.540000000000006 112.757 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.408 ' HB2' HG13 ' A' ' 130' ' ' VAL . 20.3 ttt180 -50.83 -53.35 32.91 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 121.091 0.472 . . . . 71.519999999999996 112.245 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.35 -47.94 74.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 65.310000000000002 111.985 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.45 -36.83 85.05 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.279 -0.263 . . . . 74.120000000000005 111.463 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.529 HD11 ' HG ' ' A' ' 129' ' ' LEU . 73.3 mt -57.05 -51.0 71.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.75 0.309 . . . . 70.209999999999994 111.507 176.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.5 p -77.96 -40.8 27.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 112.512 0.56 . . . . 73.319999999999993 112.512 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -63.0 -57.34 11.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.255 0.465 . . . . 72.129999999999995 112.255 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -84.88 -3.9 58.88 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.711 0.291 . . . . 75.25 111.324 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 62.29 89.71 0.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.382 0.611 . . . . 63.030000000000001 110.535 -173.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.461 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -58.97 -62.24 6.45 Favored Glycine 0 CA--C 1.521 0.438 0 CA-C-N 115.656 -0.702 . . . . 74.0 114.219 -170.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -71.55 -16.6 62.32 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.168 0.433 . . . . 71.519999999999996 112.168 -173.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -80.52 -58.08 3.28 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.989 0.423 . . . . 75.040000000000006 110.806 173.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.423 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -60.47 -34.78 86.93 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.876 -0.602 . . . . 65.299999999999997 113.1 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -54.81 -49.3 71.34 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.963 0.505 . . . . 74.420000000000002 111.508 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.66 -42.6 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 112.222 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.423 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.5 pt-20 -73.34 -27.76 61.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 111.92 0.341 . . . . 75.439999999999998 111.92 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -63.69 -45.75 88.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.182 0.515 . . . . 63.329999999999998 110.874 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -81.85 3.43 26.08 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.231 -0.441 . . . . 72.510000000000005 111.558 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 2.0 t60 58.91 37.32 24.72 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.065 0.546 . . . . 43.149999999999999 112.057 173.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.6 t . . . . . 0 CA--C 1.542 0.65 0 CA-C-O 120.953 0.406 . . . . 64.409999999999997 111.772 -179.388 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.4 t70 . . . . . 0 CA--C 1.541 0.619 0 N-CA-C 110.439 -0.208 . . . . 74.209999999999994 110.439 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.29 -42.58 91.62 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.684 0.278 . . . . 74.040000000000006 110.427 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.92 -40.61 70.04 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.022 0.439 . . . . 61.439999999999998 110.975 177.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -67.65 -39.6 84.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.154 -0.475 . . . . 73.230000000000004 110.999 176.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -67.65 -51.25 52.19 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.175 0.435 . . . . 63.340000000000003 112.175 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.508 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -52.23 -52.04 54.76 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.755 0.312 . . . . 73.129999999999995 111.382 175.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.4 p -63.98 -54.63 31.38 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 111.954 0.353 . . . . 60.310000000000002 111.954 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.7 tp -52.89 -45.48 67.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.232 0.456 . . . . 71.400000000000006 112.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -62.55 -45.46 92.83 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 120.681 0.277 . . . . 73.299999999999997 111.248 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 8' ' ' GLN . 86.0 mt -57.63 -51.34 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.243 0.544 . . . . 74.409999999999997 111.093 176.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.463 ' O ' HD13 ' A' ' 17' ' ' LEU . 77.8 mt -61.34 -47.87 91.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 115.759 -0.655 . . . . 65.230000000000004 111.486 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 41.8 t -54.35 -50.35 67.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.976 0.417 . . . . 70.409999999999997 111.467 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 35.2 mtp180 -61.33 -48.35 81.7 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.362 -0.381 . . . . 74.200000000000003 111.621 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 32.1 t80 -53.4 -48.78 68.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.879 0.371 . . . . 65.019999999999996 111.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.51 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.3 mp -59.61 -42.74 93.33 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.662 0.268 . . . . 73.150000000000006 111.421 175.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' SER . 37.2 mmt180 -60.39 -43.9 96.21 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.65 0.262 . . . . 70.129999999999995 111.429 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 81.1 mt-10 -63.98 -42.63 97.18 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.009 0.433 . . . . 74.420000000000002 111.488 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 27.7 mm-40 -71.99 -26.07 62.09 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.07 0.396 . . . . 75.530000000000001 112.07 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.427 ' O ' ' HD3' ' A' ' 110' ' ' LYS . . . -84.82 -44.39 13.31 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.33 0.492 . . . . 64.030000000000001 112.33 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -87.62 -30.19 20.65 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.017 0.377 . . . . 75.310000000000002 112.017 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.889 0 C-N-CA 121.338 -0.458 . . . . 55.420000000000002 112.876 -176.684 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.79 0 N-CA-C 112.987 -0.045 . . . . 71.450000000000003 112.987 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.507 ' HB1' ' HE2' ' A' ' 39' ' ' LYS . . . -54.31 -39.13 66.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.794 0.33 . . . . 74.5 111.576 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.6 m -54.69 -52.33 62.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.06 0.457 . . . . 71.349999999999994 111.576 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 59.6 p -67.36 -31.13 71.17 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.842 0.353 . . . . 64.120000000000005 111.856 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.443 HH11 ' HG3' ' A' ' 38' ' ' ARG . 1.1 tmm_? -66.49 -53.39 35.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.305 0.574 . . . . 73.319999999999993 110.143 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HE2' ' HB1' ' A' ' 35' ' ' ALA . 63.3 mttm -60.95 -39.32 89.04 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.625 -0.716 . . . . 61.030000000000001 111.268 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.86 -47.46 82.64 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.409 -0.36 . . . . 74.019999999999996 111.706 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.38 -52.62 63.86 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 111.846 0.313 . . . . 72.450000000000003 111.846 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.97 -39.77 90.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.771 0.319 . . . . 75.400000000000006 111.226 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.572 ' O ' HG22 ' A' ' 47' ' ' VAL . 63.7 m -66.15 -50.06 65.26 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.562 0.22 . . . . 53.140000000000001 110.818 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.9 mt -53.99 -45.18 71.36 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.258 0.466 . . . . 64.140000000000001 112.258 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HA ' ' CE1' ' A' ' 16' ' ' TYR . 5.0 ptm180 -73.97 -39.03 63.98 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 111.784 0.29 . . . . 72.340000000000003 111.784 -176.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -71.97 -35.16 69.46 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.296 -0.253 . . . . 74.430000000000007 111.679 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 43' ' ' THR . 17.6 m -87.92 -33.47 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.043 0.449 . . . . 64.439999999999998 111.366 177.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -64.3 -42.31 97.85 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-N 116.24 -0.437 . . . . 71.049999999999997 113.507 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -54.5 -42.74 71.11 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.912 0.386 . . . . 72.319999999999993 111.425 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.6 -43.65 91.64 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.104 -0.569 . . . . 70.299999999999997 112.618 176.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.476 ' HA ' HD21 ' A' ' 54' ' ' ASN . 97.3 t -59.62 -41.17 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 120.709 0.29 . . . . 65.209999999999994 111.318 177.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 78.9 mt-30 -57.96 -41.42 82.85 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.565 -0.289 . . . . 60.5 111.573 178.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 53' ' ' ARG . 16.1 mmm-85 -61.98 -56.1 22.62 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.575 0.583 . . . . 71.239999999999995 112.575 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.476 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.6 p30 -70.81 -21.84 62.42 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.031 -0.418 . . . . 51.399999999999999 111.785 -177.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -90.46 -20.47 22.7 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.514 0.561 . . . . 73.519999999999996 112.514 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -50.08 -49.57 50.95 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.729 0.64 . . . . 53.25 112.729 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -58.93 -34.01 71.24 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.852 0.358 . . . . 71.439999999999998 111.859 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.1 -43.83 23.29 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.889 0.376 . . . . 74.340000000000003 111.718 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -64.56 -39.65 94.13 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.483 -0.326 . . . . 71.200000000000003 111.373 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -53.0 -41.53 64.72 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.0 0.429 . . . . 74.209999999999994 110.816 173.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -62.74 -27.0 69.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 115.904 -0.589 . . . . 73.010000000000005 112.958 175.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.574 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 81.5 mtp -81.4 -51.42 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 122.637 -0.331 . . . . 74.510000000000005 110.97 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.9 mp -55.0 -37.44 66.6 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.542 0.571 . . . . 71.25 112.542 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -66.41 -25.43 66.76 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 111.978 0.362 . . . . 63.200000000000003 111.978 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -96.31 -16.18 21.49 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 122.106 -0.371 . . . . 73.049999999999997 110.877 175.422 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.31 -68.26 0.71 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.375 -0.375 . . . . 73.329999999999998 111.16 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 54.37 97.71 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.389 0.614 . . . . 63.340000000000003 111.938 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.504 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.3 mp -93.1 100.58 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.157 0.503 . . . . 62.509999999999998 111.19 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.423 ' HD3' HD22 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -107.27 -6.58 17.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.174 -0.466 . . . . 74.140000000000001 112.147 179.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.423 HD22 ' HD3' ' A' ' 69' ' ' LYS . 0.8 OUTLIER -155.42 174.85 14.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.825 0.345 . . . . 75.140000000000001 111.37 177.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.4 -37.37 83.2 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.289 0.477 . . . . 75.299999999999997 112.289 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.27 -39.19 66.65 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.788 0.327 . . . . 75.340000000000003 111.487 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' ILE . 48.1 m-20 -63.75 -38.28 90.5 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.066 0.46 . . . . 64.319999999999993 110.916 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.38 -46.08 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.337 0.589 . . . . 65.299999999999997 110.844 175.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 78' ' ' SER . 98.2 mttt -70.0 -23.93 63.22 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.137 -0.483 . . . . 72.109999999999999 111.223 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.2 t -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.074 0.464 . . . . 74.530000000000001 110.403 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.5 mt -57.2 -37.93 72.93 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.345 -0.388 . . . . 62.030000000000001 110.464 174.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 38.5 t -53.25 -37.9 62.51 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.14 -0.482 . . . . 71.129999999999995 111.469 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -40.27 97.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.197 0.522 . . . . 74.329999999999998 110.54 177.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.457 ' HA ' ' CD2' ' A' ' 83' ' ' HIS . 61.5 t -66.94 -39.79 84.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.072 -0.513 . . . . 64.430000000000007 110.647 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.543 ' HB3' HD11 ' A' ' 98' ' ' LEU . 21.4 mmt -55.39 -40.51 71.48 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.864 -0.607 . . . . 54.149999999999999 111.211 177.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' SER . 73.7 mt -60.74 -33.55 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 116.078 -0.51 . . . . 75.430000000000007 111.349 174.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.457 ' CD2' ' HA ' ' A' ' 80' ' ' VAL . 27.1 m-70 -72.8 -28.86 62.82 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.516 -0.311 . . . . 65.239999999999995 111.687 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 92.2 t -58.02 -28.84 34.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 121.064 0.459 . . . . 63.450000000000003 111.711 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.509 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 74.0 m-85 . . . . . 0 CA--C 1.543 0.674 0 N-CA-C 112.853 0.686 . . . . 75.510000000000005 112.853 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.494 ' HE3' HG13 ' A' ' 95' ' ' ILE . 81.8 m95 . . . . . 0 CA--C 1.542 0.636 0 N-CA-C 112.525 0.565 . . . . 71.010000000000005 112.525 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.1 -31.59 73.42 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.189 -0.529 . . . . 71.099999999999994 112.786 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' A' ' 85' ' ' PHE . 65.8 mtm180 -66.23 -36.2 82.39 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.393 -0.475 . . . . 71.409999999999997 111.188 175.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.494 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.4 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.134 0.492 . . . . 74.200000000000003 110.501 176.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.19 -49.91 81.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.115 -0.493 . . . . 60.350000000000001 111.178 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.8 m -56.01 -41.96 75.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.39 -0.368 . . . . 72.019999999999996 111.473 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.543 HD11 ' HB3' ' A' ' 81' ' ' MET . 35.9 tp -61.33 -55.1 35.45 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.27 0.557 . . . . 74.439999999999998 111.896 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.401 HG23 HG23 ' A' ' 13' ' ' ILE . 58.0 mt -72.04 -35.26 53.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 116.14 -0.482 . . . . 73.530000000000001 111.955 -174.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.2 p -64.7 -44.89 88.81 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.581 0.229 . . . . 63.329999999999998 111.044 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -60.26 -41.32 93.01 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.797 0.332 . . . . 74.329999999999998 110.991 176.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.71 -43.83 94.33 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.858 -0.686 . . . . 62.439999999999998 112.468 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.14 -35.18 79.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.981 0.42 . . . . 74.219999999999999 111.439 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.413 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 51.3 t80 -62.44 -42.61 99.59 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 111.018 177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.442 ' HB ' HD11 ' A' ' 121' ' ' LEU . 47.3 t -71.46 -38.3 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.737 0.303 . . . . 71.349999999999994 110.863 175.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.97 73.33 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.345 0.498 . . . . 55.130000000000003 112.345 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 19.4 ptpt -61.43 -36.16 79.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.111 0.481 . . . . 72.439999999999998 110.925 178.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -68.58 -34.72 76.3 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.376 -0.375 . . . . 74.040000000000006 110.89 176.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.498 HD11 HD12 ' A' ' 121' ' ' LEU . 90.0 mt -62.63 -50.36 71.55 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.639 0.257 . . . . 63.219999999999999 111.073 177.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 56.6 tttm -61.74 -35.14 77.23 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.905 0.383 . . . . 74.400000000000006 111.041 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.2 m -60.48 -41.14 93.62 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.414 -0.357 . . . . 73.540000000000006 111.491 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.4 pt -92.94 18.88 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.864 0.364 . . . . 74.109999999999999 111.876 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 67.59 16.21 9.85 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.182 0.808 . . . . 73.409999999999997 113.182 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -91.95 40.84 1.05 Allowed 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.96 0.409 . . . . 52.100000000000001 110.795 173.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.98 -40.8 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.017 0.527 . . . . 71.340000000000003 111.812 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 88.3 p -62.94 -33.59 75.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.027 0.38 . . . . 73.219999999999999 112.027 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.428 ' HB2' HD13 ' A' ' 109' ' ' LEU . 49.4 m -58.24 -26.11 62.5 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.353 0.501 . . . . 72.409999999999997 112.353 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 70.0 mt -54.38 -36.03 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 112.295 0.48 . . . . 62.43 112.295 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -67.08 -58.3 9.45 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 112.331 0.493 . . . . 63.219999999999999 112.331 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -57.32 -28.68 81.04 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.634 1.556 . . . . 50.140000000000001 112.092 175.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.498 HD12 HD11 ' A' ' 109' ' ' LEU . 5.0 tt -64.41 -50.45 67.55 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 110.008 -0.368 . . . . 72.109999999999999 110.008 175.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.28 76.21 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.174 0.511 . . . . 63.439999999999998 111.137 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.77 -29.19 67.52 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.325 -0.398 . . . . 71.019999999999996 111.594 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.0 m -69.34 -43.52 73.51 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.843 0.354 . . . . 42.149999999999999 111.089 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.441 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.6 mm -55.73 -52.92 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.367 0.603 . . . . 65.219999999999999 110.43 174.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.4 m -65.43 -35.97 82.52 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.419 -0.81 . . . . 70.340000000000003 111.666 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.9 t70 -57.53 -52.54 64.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.733 0.302 . . . . 74.530000000000001 110.996 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 132' ' ' THR . 62.1 t -64.36 -42.8 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 120.937 0.399 . . . . 73.099999999999994 111.053 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -53.89 -52.84 59.24 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.335 0.588 . . . . 72.439999999999998 111.351 178.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.76 -30.74 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.856 -0.611 . . . . 62.240000000000002 111.376 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.1 tpt180 -57.47 -49.69 75.47 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.121 0.486 . . . . 63.140000000000001 112.179 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.9 t -104.39 -29.56 10.66 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.906 1.076 . . . . 70.519999999999996 113.906 -172.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -130.47 22.44 5.13 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.081 1.141 . . . . 74.5 114.081 -171.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' A' ' 137' ' ' LEU . 33.8 ttp180 -54.47 -43.35 71.64 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-O 121.011 0.434 . . . . 71.129999999999995 111.983 175.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 33.8 t70 -58.65 -49.58 77.0 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.21 -0.45 . . . . 65.310000000000002 111.525 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.46 -35.74 81.82 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.774 0.287 . . . . 72.420000000000002 111.774 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.532 HD11 ' HG ' ' A' ' 129' ' ' LEU . 55.9 mt -51.81 -48.45 63.87 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.661 0.267 . . . . 72.319999999999993 111.501 174.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.79 -31.85 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 112.446 0.536 . . . . 63.140000000000001 112.446 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 45.1 mmtm -65.47 -64.33 0.89 Allowed 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.965 -0.46 . . . . 71.329999999999998 112.186 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -85.6 4.02 38.11 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.419 -0.355 . . . . 75.25 111.247 -176.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 51.49 72.17 0.39 Allowed 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.231 0.539 . . . . 72.230000000000004 110.084 -172.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.33 -50.29 6.63 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.218 -0.901 . . . . 70.010000000000005 114.793 -171.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.457 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.5 m95 -72.95 -26.26 61.32 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.32 0.489 . . . . 74.530000000000001 112.32 -175.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -76.42 -53.93 7.45 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.279 0.562 . . . . 72.239999999999995 110.587 173.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.446 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -58.39 -33.64 71.82 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.716 -0.675 . . . . 71.409999999999997 112.673 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.56 -45.71 81.13 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.301 0.572 . . . . 74.430000000000007 111.58 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.499 HG13 ' HB ' ' A' ' 152' ' ' VAL . 47.2 t -70.26 -42.34 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.941 -0.572 . . . . 65.120000000000005 112.026 -177.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.446 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.8 pt-20 -73.34 -27.89 61.76 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.783 0.325 . . . . 74.409999999999997 111.36 177.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -61.89 -48.96 78.16 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.575 0.35 . . . . 71.450000000000003 111.675 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -83.21 -10.99 58.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 111.961 0.356 . . . . 64.319999999999993 111.961 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 65.75 74.83 0.36 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.197 0.522 . . . . 62.509999999999998 111.405 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 147' ' ' VAL . 59.9 t . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 73.310000000000002 110.158 174.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.5 t70 . . . . . 0 CA--C 1.542 0.648 0 CA-C-O 120.755 0.312 . . . . 72.450000000000003 110.668 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -55.52 -41.58 73.31 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.891 0.377 . . . . 44.210000000000001 111.305 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.6 tp -55.93 -46.79 78.37 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.045 -0.525 . . . . 40.43 110.9 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -62.72 -43.26 99.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.155 -0.475 . . . . 73.0 110.879 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -58.47 -44.63 89.38 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.341 0.497 . . . . 52.109999999999999 112.341 177.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.441 ' O ' HG13 ' A' ' 12' ' ' ILE . 47.7 tt0 -73.15 -45.03 59.03 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.707 0.262 . . . . 61.340000000000003 111.707 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.0 p -60.91 -53.1 61.45 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.695 0.283 . . . . 62.240000000000002 111.148 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.9 tp -54.53 -40.83 69.03 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.379 -0.373 . . . . 54.229999999999997 111.559 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.39 -51.64 68.6 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.132 0.491 . . . . 65.010000000000005 111.317 178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 8' ' ' GLN . 57.2 mt -64.21 -49.75 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.043 -0.526 . . . . 74.109999999999999 111.37 -178.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.417 ' O ' HD13 ' A' ' 17' ' ' LEU . 86.0 mt -62.32 -47.29 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 116.224 -0.444 . . . . 72.030000000000001 111.662 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 39.3 t -54.66 -54.6 39.57 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.512 -0.313 . . . . 73.430000000000007 111.642 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -60.27 -45.84 91.89 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.666 -0.243 . . . . 73.25 111.499 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -56.12 -48.54 76.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.884 0.373 . . . . 71.099999999999994 111.555 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.1 mp -59.39 -41.89 90.44 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.741 -0.209 . . . . 73.439999999999998 111.452 176.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 22.1 mmm180 -63.79 -55.36 23.64 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 111.688 0.255 . . . . 73.409999999999997 111.688 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 6.9 pt-20 -61.62 -40.6 95.43 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.015 0.376 . . . . 74.200000000000003 112.015 -177.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.7 mm-40 -70.66 -22.74 62.46 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.161 -0.337 . . . . 74.519999999999996 111.439 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -80.04 -43.06 22.55 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 111.88 0.326 . . . . 75.319999999999993 111.88 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.5 p -87.4 -16.83 33.78 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.924 0.392 . . . . 70.310000000000002 111.662 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.699 0 C-N-CA 121.105 -0.569 . . . . 74.109999999999999 112.527 -176.569 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.718 0 CA-C-O 120.452 -0.082 . . . . 52.119999999999997 113.164 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.38 -49.67 75.44 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.183 0.438 . . . . 73.439999999999998 112.183 -176.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.4 m -60.47 -41.06 93.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.092 0.472 . . . . 64.120000000000005 111.107 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.3 m -62.99 -42.39 99.83 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.273 -0.422 . . . . 74.340000000000003 111.15 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -63.55 -55.95 19.79 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.888 0.375 . . . . 65.329999999999998 111.572 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 147' ' ' VAL . 3.2 ptmm? -63.18 -29.36 70.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.34 -0.391 . . . . 73.209999999999994 111.404 -174.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.16 82.36 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.929 0.395 . . . . 74.010000000000005 111.06 173.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.2 tp -59.22 -54.39 47.43 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.306 -0.407 . . . . 71.319999999999993 111.92 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.37 -24.79 64.83 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.025 0.379 . . . . 75.519999999999996 112.025 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.495 HG23 HG21 ' A' ' 152' ' ' VAL . 28.3 m -66.49 -42.52 87.28 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 122.106 -0.371 . . . . 75.450000000000003 110.3 169.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.4 mt -56.41 -31.89 64.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.691 0.282 . . . . 53.409999999999997 111.513 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -68.76 -54.45 15.94 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.289 0.566 . . . . 61.130000000000003 110.68 174.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 24.3 ttt180 -56.46 -44.84 80.91 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.287 -0.869 . . . . 63.530000000000001 112.416 -177.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 43' ' ' THR . 15.6 m -93.72 -33.08 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.179 0.437 . . . . 74.010000000000005 112.179 -178.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.63 -49.52 59.52 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.229 -0.51 . . . . 65.439999999999998 113.602 -174.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.541 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 14.8 t70 -61.57 -35.99 79.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 117.223 0.512 . . . . 64.310000000000002 110.751 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.9 -50.15 70.83 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 121.075 -0.583 . . . . 75.030000000000001 112.089 174.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.491 ' HA ' HD21 ' A' ' 54' ' ' ASN . 86.8 t -58.23 -38.46 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.831 0.348 . . . . 74.120000000000005 111.192 176.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.4 mt-30 -57.01 -50.56 72.34 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.616 -0.265 . . . . 73.310000000000002 111.2 175.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 15.2 mmp_? -55.26 -50.18 70.14 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.904 0.705 . . . . 73.219999999999999 112.904 -175.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.491 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -78.39 -23.1 46.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 112.59 0.589 . . . . 71.420000000000002 112.59 -177.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -91.68 -16.96 26.2 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.629 0.603 . . . . 72.099999999999994 112.629 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -48.61 -57.95 5.44 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.508 0.929 . . . . 74.030000000000001 113.508 -167.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -62.49 -31.36 72.09 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.08 0.466 . . . . 63.450000000000003 111.523 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.41 -30.5 67.4 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.988 0.423 . . . . 61.340000000000003 111.216 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -76.98 -43.04 36.46 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.422 -0.354 . . . . 72.420000000000002 111.224 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -52.05 -40.0 60.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.825 0.345 . . . . 64.120000000000005 111.49 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.94 -33.36 56.8 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 121.4 -0.429 . . . . 72.549999999999997 113.603 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 67.0 mtm -91.0 -37.29 13.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.494 0.664 . . . . 71.25 110.44 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 63' ' ' LEU . 13.4 tp -63.44 -38.08 89.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.483 -0.78 . . . . 72.530000000000001 111.786 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.72 -39.8 74.55 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.232 -0.44 . . . . 73.049999999999997 112.183 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -2.62 58.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.833 0.349 . . . . 74.129999999999995 111.636 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.09 -75.7 0.51 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.94 0.4 . . . . 75.010000000000005 110.99 174.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 43.34 83.37 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.48 -0.782 . . . . 62.340000000000003 111.063 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.602 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.6 mp -60.31 113.61 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.716 -0.675 . . . . 72.510000000000005 112.031 -172.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -104.32 -8.98 18.86 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.986 -0.552 . . . . 61.340000000000003 112.155 -179.497 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.429 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -166.35 179.75 5.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.911 0.386 . . . . 45.310000000000002 111.759 173.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -53.63 -38.8 64.41 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.563 0.579 . . . . 71.099999999999994 112.563 -178.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.16 -39.21 63.41 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.825 0.345 . . . . 61.25 111.79 -178.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.546 ' HB2' HG23 ' A' ' 68' ' ' ILE . 21.7 m-20 -69.26 -34.47 74.82 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.947 0.404 . . . . 73.140000000000001 110.812 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.55 -39.58 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.271 0.557 . . . . 75.310000000000002 110.324 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -62.95 -38.83 92.66 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.174 0.511 . . . . 74.439999999999998 110.451 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 45.7 t -62.86 -34.14 76.75 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.095 -0.502 . . . . 62.520000000000003 111.33 174.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.498 HD21 HD11 ' A' ' 68' ' ' ILE . 90.4 mt -62.48 -40.01 95.32 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.734 0.302 . . . . 71.239999999999995 111.024 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.5 t -52.53 -38.54 59.89 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.176 0.513 . . . . 71.230000000000004 111.194 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -58.09 -41.03 82.6 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.051 -0.522 . . . . 73.310000000000002 110.894 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.06 -41.29 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 120.951 0.405 . . . . 63.200000000000003 110.725 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.2 mmt -54.7 -40.68 69.41 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.992 -0.549 . . . . 73.0 111.241 178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.31 -32.67 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-O 121.085 0.469 . . . . 60.310000000000002 111.313 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -74.31 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 111.829 0.307 . . . . 61.520000000000003 111.829 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 67.9 t -57.66 -43.01 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.091 0.472 . . . . 71.340000000000003 111.342 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.2 m-85 . . . . . 0 N--CA 1.47 0.55 0 CA-C-O 121.033 0.444 . . . . 73.519999999999996 111.963 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.488 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.6 m95 . . . . . 0 CA--C 1.542 0.648 0 N-CA-C 112.423 0.527 . . . . 72.540000000000006 112.423 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.36 -35.78 51.46 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.239 -0.505 . . . . 62.039999999999999 113.05 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -56.65 -43.05 79.94 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.942 0.401 . . . . 73.120000000000005 111.592 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' HE3' ' A' ' 92' ' ' TRP . 43.9 mm -66.68 -43.29 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-O 121.078 0.465 . . . . 72.209999999999994 110.322 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.9 t -57.38 -42.32 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.026 -0.534 . . . . 72.040000000000006 110.595 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.3 m -57.4 -46.76 83.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 72.420000000000002 111.417 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.506 ' HG ' HG23 ' A' ' 125' ' ' ILE . 31.2 tp -58.35 -54.52 46.07 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.142 0.496 . . . . 70.319999999999993 111.381 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.2 mt -65.53 -37.96 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.055 -0.52 . . . . 74.030000000000001 111.959 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.4 m -63.19 -45.82 89.94 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 116.565 -0.289 . . . . 71.299999999999997 111.355 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -65.49 -39.5 91.97 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 120.768 0.318 . . . . 75.540000000000006 110.863 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.87 -47.93 85.58 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.962 -0.637 . . . . 54.399999999999999 112.377 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.498 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.35 -32.29 73.6 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.854 0.359 . . . . 75.439999999999998 111.341 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.456 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 39.0 t80 -63.51 -42.84 98.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.081 0.467 . . . . 51.5 111.12 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.491 HG11 HD11 ' A' ' 77' ' ' LEU . 45.5 t -72.2 -40.47 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.932 0.396 . . . . 72.299999999999997 110.674 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.442 ' HB1' HG23 ' A' ' 118' ' ' ILE . . . -58.3 -45.3 88.26 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.139 -0.482 . . . . 63.020000000000003 112.291 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 17.1 ptmt -64.12 -32.94 74.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.783 0.325 . . . . 71.299999999999997 111.031 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.31 -34.24 75.77 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.748 0.309 . . . . 55.219999999999999 110.553 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.602 HD21 ' HB ' ' A' ' 68' ' ' ILE . 92.9 mt -61.82 -49.23 77.12 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.747 0.308 . . . . 72.450000000000003 111.148 176.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.425 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 8.5 tmtm? -54.29 -44.3 71.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 110.066 -0.346 . . . . 74.329999999999998 110.066 176.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.7 m -52.67 -50.53 63.08 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.223 -0.444 . . . . 53.130000000000003 111.863 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 38.6 pt -87.29 15.78 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 112.562 0.578 . . . . 74.430000000000007 112.562 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 68.51 18.29 8.95 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.938 0.718 . . . . 73.239999999999995 112.938 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -91.66 43.27 1.13 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.011 0.434 . . . . 71.010000000000005 111.265 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.91 -17.54 61.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.078 0.399 . . . . 64.409999999999997 112.078 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.446 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 72.2 p -71.48 -48.3 50.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.91 0.386 . . . . 73.510000000000005 111.012 173.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.487 ' HB2' HD13 ' A' ' 109' ' ' LEU . 24.5 m -56.7 -28.23 60.47 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.061 -0.518 . . . . 73.530000000000001 111.991 -177.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.442 HG23 ' HB1' ' A' ' 106' ' ' ALA . 70.9 mt -55.45 -40.95 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 112.639 0.607 . . . . 71.150000000000006 112.639 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.06 -53.95 22.75 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 112.203 0.445 . . . . 63.219999999999999 112.203 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.446 ' HD2' ' O ' ' A' ' 116' ' ' SER . 23.5 Cg_endo -62.02 -25.04 77.31 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 121.579 1.519 . . . . 64.239999999999995 112.438 173.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 109' ' ' LEU . 3.9 tt -61.25 -46.48 90.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.698 -0.482 . . . . 73.540000000000006 109.698 174.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.05 -33.75 65.28 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.052 0.453 . . . . 64.530000000000001 111.439 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -68.18 -39.44 82.51 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 111.914 177.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 98.3 p -63.35 -47.48 81.95 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.815 0.28 . . . . 63.310000000000002 111.099 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.506 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.9 mm -52.86 -53.23 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.384 0.611 . . . . 74.209999999999994 111.028 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.8 m -66.67 -35.83 81.09 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.671 -0.695 . . . . 65.510000000000005 111.612 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.617 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 33.3 t70 -61.0 -53.0 62.63 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.755 -0.202 . . . . 72.549999999999997 110.912 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.75 -41.42 92.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 120.95 0.405 . . . . 55.420000000000002 111.097 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.6 ' HG ' HD11 ' A' ' 137' ' ' LEU . 24.8 tp -52.9 -52.52 57.28 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.284 0.564 . . . . 61.009999999999998 111.036 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 89.2 t -74.16 -35.22 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.97 -0.559 . . . . 55.140000000000001 111.576 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.617 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.1 ttt180 -54.83 -32.8 60.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.114 0.566 . . . . 73.129999999999995 112.106 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.75 HG23 ' HD2' ' A' ' 133' ' ' LYS . 1.6 t -127.1 -18.97 4.46 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 52.520000000000003 113.765 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.75 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.3 mptp? -123.68 20.95 9.34 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.17 0.804 . . . . 74.430000000000007 113.17 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 48.3 ttp180 -45.66 -64.11 0.81 Allowed 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.228 0.537 . . . . 72.109999999999999 112.424 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.12 -40.24 93.04 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.742 -0.663 . . . . 73.5 111.826 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -60.04 -42.07 93.62 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 122.239 -0.288 . . . . 71.109999999999999 111.61 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.6 HD11 ' HG ' ' A' ' 129' ' ' LEU . 83.3 mt -53.18 -52.53 58.54 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.942 0.401 . . . . 75.209999999999994 111.523 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.13 -38.33 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 112.326 0.491 . . . . 53.409999999999997 112.326 -176.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -65.11 -40.99 95.3 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.22 0.452 . . . . 70.120000000000005 112.22 -177.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -89.76 0.94 56.69 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.352 -0.217 . . . . 74.040000000000006 111.576 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 55.16 74.06 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.614 0.721 . . . . 65.420000000000002 110.07 -173.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.435 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -53.47 -68.58 1.56 Allowed Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.97 -1.014 . . . . 44.229999999999997 115.173 -168.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -67.16 -12.42 59.97 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.156 0.428 . . . . 74.099999999999994 112.156 -173.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -84.42 -58.37 2.77 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.993 0.425 . . . . 71.349999999999994 110.566 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.545 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -62.58 -30.27 76.12 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.029 -0.532 . . . . 72.420000000000002 113.053 178.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -53.96 -47.7 71.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.338 0.589 . . . . 63.009999999999998 111.474 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 39' ' ' LYS . 24.3 t -73.79 -39.46 52.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.867 -0.606 . . . . 71.439999999999998 112.293 -174.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.545 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 9.2 pt-20 -66.91 -38.65 86.62 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.825 0.345 . . . . 70.329999999999998 110.677 176.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . 0.434 ' N ' ' HG3' ' A' ' 148' ' ' GLU . 84.3 t80 -53.69 -48.02 69.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.286 -0.416 . . . . 64.109999999999999 111.716 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -82.41 -5.47 58.67 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.791 0.329 . . . . 72.400000000000006 111.634 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 59.31 26.41 15.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.375 0.67 . . . . 73.409999999999997 112.373 174.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.495 HG21 HG23 ' A' ' 43' ' ' THR . 96.7 t . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 121.023 0.44 . . . . 73.019999999999996 112.053 -176.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 CA--C 1.54 0.59 0 CA-C-O 120.874 0.369 . . . . 74.340000000000003 110.985 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -54.28 -43.88 71.43 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.14 0.495 . . . . 65.340000000000003 111.245 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.2 tp -59.75 -34.91 73.58 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.839 -0.618 . . . . 73.019999999999996 111.437 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -66.65 -46.03 77.06 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.37 -0.377 . . . . 65.340000000000003 110.331 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -60.75 -43.64 97.7 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.972 0.415 . . . . 75.150000000000006 111.22 177.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -56.17 -53.71 53.91 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.343 0.592 . . . . 71.340000000000003 111.131 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.3 m -64.98 -43.78 91.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.659 -0.7 . . . . 55.439999999999998 111.495 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.78 -44.69 93.78 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.377 -0.374 . . . . 75.439999999999998 111.555 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.35 -51.35 69.77 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.263 0.554 . . . . 74.030000000000001 111.193 177.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.449 HG23 ' HB2' ' A' ' 41' ' ' LEU . 68.1 mt -59.85 -54.06 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.93 -0.577 . . . . 74.239999999999995 111.6 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.475 HD13 HG22 ' A' ' 125' ' ' ILE . 81.1 mt -61.99 -42.26 94.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 116.132 -0.485 . . . . 72.420000000000002 111.822 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.8 t -55.07 -53.88 50.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.89 0.376 . . . . 71.129999999999995 111.836 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.69 -39.15 93.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.552 -0.295 . . . . 62.509999999999998 111.511 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 57.0 t80 -59.85 -49.06 79.19 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.09 0.471 . . . . 71.109999999999999 111.489 178.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.0 mp -62.71 -38.13 89.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.765 0.317 . . . . 73.319999999999993 111.211 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -65.73 -43.31 89.41 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.011 0.375 . . . . 62.450000000000003 112.011 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 3.2 pt-20 -69.49 -39.65 77.51 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.109 -0.369 . . . . 74.299999999999997 111.571 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.506 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.6 mm-40 -71.43 -28.08 63.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.788 0.328 . . . . 74.019999999999996 111.397 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.57 -41.87 44.83 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 111.872 0.323 . . . . 62.200000000000003 111.872 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.3 p -88.27 -29.97 20.0 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.032 0.444 . . . . 63.109999999999999 112.184 -178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.947 0 C-N-CA 121.427 -0.416 . . . . 42.310000000000002 112.398 -174.558 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 CA-C-O 120.847 0.137 . . . . 34.439999999999998 112.797 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.33 68.44 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.152 0.427 . . . . 75.219999999999999 112.152 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.575 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . 59.8 m -59.53 -52.04 67.26 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.276 0.472 . . . . 75.349999999999994 112.276 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.9 p -61.05 -45.48 94.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.296 -0.411 . . . . 75.049999999999997 111.461 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -46.27 81.7 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 111.864 0.32 . . . . 75.019999999999996 111.864 179.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.669 ' HG3' HG21 ' A' ' 147' ' ' VAL . 24.2 pttm -67.17 -28.8 68.41 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.088 -0.382 . . . . 73.150000000000006 111.62 -178.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.32 -51.92 64.01 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.925 0.393 . . . . 74.420000000000002 110.498 173.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB2' HG23 ' A' ' 12' ' ' ILE . 65.5 tp -59.01 -44.85 91.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.31 0.576 . . . . 72.510000000000005 111.208 175.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.37 -41.2 88.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.781 -0.645 . . . . 74.25 111.161 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.1 m -72.1 -38.35 69.35 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.315 -0.402 . . . . 54.32 111.02 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.0 mt -53.64 -47.05 70.68 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 111.944 0.35 . . . . 72.209999999999994 111.944 177.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -74.14 -29.78 61.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.774 0.321 . . . . 74.310000000000002 111.42 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -63.45 -45.1 92.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.796 0.331 . . . . 72.310000000000002 111.396 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.84 -30.4 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.028 0.442 . . . . 71.439999999999998 111.468 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.39 -44.39 97.65 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.921 -0.582 . . . . 61.039999999999999 112.953 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 23.1 t70 -50.84 -57.37 8.62 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.837 0.351 . . . . 64.209999999999994 110.955 176.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.07 -45.13 92.75 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.399 -0.429 . . . . 45.439999999999998 113.548 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 85.1 t -62.92 -42.62 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.883 0.373 . . . . 64.549999999999997 111.508 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 27.8 mt-30 -66.74 -27.5 67.66 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.024 0.379 . . . . 75.540000000000006 112.024 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 21.6 mmt180 -64.07 -42.84 96.84 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.389 . . . . 73.510000000000005 111.193 175.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -84.05 -49.82 8.55 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.117 0.484 . . . . 72.329999999999998 112.272 -176.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -75.06 -20.99 59.29 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.317 0.858 . . . . 72.040000000000006 113.317 -172.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' A' ' 52' ' ' GLN . 42.7 tt0 -50.49 -52.51 37.66 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.102 0.408 . . . . 64.129999999999995 112.102 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -55.69 -36.96 67.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.962 0.41 . . . . 61.020000000000003 111.824 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.32 62.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.916 0.389 . . . . 74.209999999999994 111.565 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -66.17 -37.94 86.84 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.545 -0.298 . . . . 65.329999999999998 111.507 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.625 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 79.4 mm-40 -48.86 -49.49 39.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 74.519999999999996 111.175 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -32.28 52.93 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.242 -0.436 . . . . 53.109999999999999 113.689 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.408 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 46.2 mtm -89.37 -30.22 18.54 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.241 0.543 . . . . 73.219999999999999 110.356 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.8 tp -63.04 -30.78 71.87 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 63.229999999999997 111.021 -178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.625 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 61.6 mtp180 -68.24 -16.55 64.01 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.934 -0.576 . . . . 72.140000000000001 112.222 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.37 5.85 23.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.001 0.429 . . . . 72.040000000000006 111.332 176.104 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 98.5 mt -103.85 -73.72 0.66 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.292 -0.413 . . . . 75.230000000000004 111.226 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 38.26 87.06 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.125 0.787 . . . . 74.200000000000003 113.125 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -65.92 113.5 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.401 -0.818 . . . . 75.450000000000003 112.065 -176.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -99.91 -6.03 27.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.375 -0.375 . . . . 53.43 111.641 177.581 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.565 HD21 ' HB3' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -173.36 174.62 3.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 120.932 0.396 . . . . 72.349999999999994 111.644 172.009 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -50.84 -30.48 14.52 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.493 0.553 . . . . 73.420000000000002 112.493 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.565 ' HB3' HD21 ' A' ' 70' ' ' ASN . 29.8 t70 -52.99 -41.75 64.9 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.122 0.487 . . . . 71.340000000000003 111.444 176.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 17.4 m-20 -73.18 -28.42 62.2 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.301 -0.409 . . . . 62.299999999999997 111.122 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -62.19 -40.92 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.299 0.571 . . . . 74.230000000000004 110.386 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.99 -30.72 70.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.042 -0.526 . . . . 74.340000000000003 110.851 174.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.5 t -66.06 -37.63 86.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.181 0.515 . . . . 51.420000000000002 110.529 171.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.4 mt -62.13 -38.11 87.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.225 -0.443 . . . . 70.530000000000001 110.873 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.8 t -52.74 -41.02 63.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.983 0.42 . . . . 72.310000000000002 111.198 177.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -55.5 -47.24 76.5 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.212 -0.449 . . . . 74.310000000000002 110.752 175.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.4 ' HA ' ' HD2' ' A' ' 83' ' ' HIS . 64.9 t -63.61 -41.79 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.969 0.414 . . . . 54.409999999999997 111.007 176.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.488 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.8 mmt -56.18 -41.99 76.39 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.046 -0.525 . . . . 74.549999999999997 111.206 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.67 -37.3 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.16 -0.473 . . . . 74.329999999999998 110.957 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.4 ' HD2' ' HA ' ' A' ' 80' ' ' VAL . 80.8 m-70 -65.11 -28.83 69.71 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 122.339 -0.225 . . . . 70.430000000000007 111.388 177.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.99 -39.62 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 51.32 110.994 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.542 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 26.9 m-85 . . . . . 0 CA--C 1.54 0.579 0 CA-C-N 116.302 -0.408 . . . . 71.439999999999998 112.034 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 94.1 m95 . . . . . 0 N--CA 1.471 0.615 0 N-CA-C 112.109 0.411 . . . . 65.349999999999994 112.109 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.94 -26.83 55.88 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 121.416 -0.421 . . . . 53.109999999999999 112.998 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -62.67 -42.17 99.48 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.054 0.454 . . . . 53.030000000000001 110.369 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -63.27 -45.26 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.896 -0.593 . . . . 72.439999999999998 110.561 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.44 -48.41 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.982 -0.553 . . . . 72.340000000000003 110.948 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.4 m -57.26 -45.66 83.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.22 -0.446 . . . . 72.329999999999998 111.563 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.542 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 23.8 tp -57.77 -54.94 41.2 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.343 0.592 . . . . 73.040000000000006 111.797 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.441 HG22 ' CD2' ' A' ' 16' ' ' TYR . 51.7 mt -71.62 -37.53 63.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.864 -0.607 . . . . 71.409999999999997 112.08 -174.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 92.3 p -66.94 -44.08 81.53 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.631 0.253 . . . . 42.350000000000001 111.263 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.48 -40.19 93.64 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.799 0.333 . . . . 53.32 110.717 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.14 -47.61 86.22 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.895 -0.669 . . . . 75.049999999999997 112.365 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.01 79.6 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.098 0.475 . . . . 62.420000000000002 111.5 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.426 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 80.2 t80 -62.01 -45.73 92.29 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.059 -0.519 . . . . 74.519999999999996 111.325 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 56.2 t -69.93 -38.39 75.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 120.836 0.351 . . . . 75.540000000000006 110.787 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.76 69.13 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.292 0.479 . . . . 74.030000000000001 112.292 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 18.1 ptpt -62.83 -36.55 83.57 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.851 0.357 . . . . 73.340000000000003 111.227 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.423 ' O ' HG12 ' A' ' 112' ' ' ILE . 71.7 t60 -65.3 -33.7 76.59 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.909 0.385 . . . . 65.120000000000005 110.33 176.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.504 HD21 ' HB ' ' A' ' 68' ' ' ILE . 89.0 mt -67.41 -50.56 58.96 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.203 -0.453 . . . . 74.439999999999998 111.093 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -57.04 -40.57 77.02 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.166 0.508 . . . . 63.43 110.477 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.8 m -55.97 -48.91 74.95 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.604 -0.725 . . . . 43.219999999999999 111.699 175.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 108' ' ' HIS . 37.1 pt -88.7 22.2 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 N-CA-C 112.142 0.423 . . . . 52.229999999999997 112.142 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 68.32 12.11 8.61 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.918 0.71 . . . . 74.400000000000006 112.918 174.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -94.76 38.08 1.12 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.289 0.477 . . . . 71.310000000000002 112.289 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.87 -32.27 63.53 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.924 -0.485 . . . . 75.030000000000001 110.87 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.7 m -56.9 -29.1 62.71 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.216 -0.447 . . . . 74.329999999999998 111.873 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.474 ' HB2' HD13 ' A' ' 109' ' ' LEU . 44.5 m -76.99 -27.07 54.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.485 -0.325 . . . . 55.5 111.706 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.9 mt -59.54 -38.47 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.95 0.352 . . . . 73.019999999999996 111.95 -179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.7 -57.17 28.4 Favored Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 112.058 0.392 . . . . 72.129999999999995 112.058 -176.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.74 -26.9 60.22 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 121.669 1.579 . . . . 73.019999999999996 112.367 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.81 -48.42 76.92 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.706 0.288 . . . . 75.219999999999999 110.235 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.39 -40.69 71.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.223 0.535 . . . . 70.420000000000002 111.001 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.69 -35.84 79.57 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.928 -0.578 . . . . 64.409999999999997 111.357 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.6 m -63.68 -45.41 90.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.731 0.301 . . . . 62.0 111.314 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.477 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.5 mm -54.84 -50.64 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.352 0.596 . . . . 73.120000000000005 110.636 175.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 26.7 m -67.93 -33.63 75.06 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.545 -0.752 . . . . 61.149999999999999 111.52 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.435 ' O ' ' HD3' ' A' ' 131' ' ' ARG . 15.2 t70 -64.02 -52.73 58.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.375 -0.375 . . . . 51.299999999999997 110.681 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 98.5 t -62.49 -41.73 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.149 0.5 . . . . 70.230000000000004 110.821 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' ' 137' ' ' LEU . 48.9 tp -54.32 -52.8 60.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.848 -0.614 . . . . 75.230000000000004 111.235 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 83.2 t -76.02 -27.33 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 111.9 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 127' ' ' ASP . 0.7 OUTLIER -54.85 -38.12 67.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.22 0.452 . . . . 75.049999999999997 112.22 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.417 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.5 OUTLIER -130.46 -37.41 1.4 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.154 0.798 . . . . 64.340000000000003 113.154 -175.776 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.417 ' HD2' HG23 ' A' ' 132' ' ' THR . 0.2 OUTLIER -92.5 6.16 48.15 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.971 0.73 . . . . 40.530000000000001 112.971 -177.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 12.7 ttp180 -49.83 -64.44 0.81 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.719 0.637 . . . . 74.310000000000002 112.719 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.09 -34.06 69.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 75.420000000000002 111.924 -178.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . 0.411 ' HD1' ' HA ' ' A' ' 133' ' ' LYS . 50.3 m95 -65.79 -36.52 83.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.303 -0.248 . . . . 74.109999999999999 111.222 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.582 ' HB2' HD21 ' A' ' 5' ' ' LEU . 78.5 mt -57.7 -49.01 77.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.811 0.338 . . . . 72.0 111.555 175.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.71 -38.02 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 N-CA-C 112.3 0.482 . . . . 73.510000000000005 112.3 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -69.66 -50.31 45.28 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.09 0.404 . . . . 73.450000000000003 112.09 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -85.41 1.8 47.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.69 0.281 . . . . 72.140000000000001 111.342 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 141' ' ' ARG . 23.2 mtp85 51.59 52.75 14.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.078 -0.51 . . . . 75.310000000000002 110.919 -175.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -41.89 -58.04 3.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 114.994 0.758 . . . . 50.219999999999999 114.994 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -64.25 -20.25 65.92 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 117.512 0.656 . . . . 72.010000000000005 112.629 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -86.52 -57.8 2.86 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.942 0.401 . . . . 74.200000000000003 111.511 172.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.3 -34.73 89.26 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.363 -0.38 . . . . 63.240000000000002 114.007 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -58.12 -37.62 74.93 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.091 0.472 . . . . 65.540000000000006 111.708 177.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.669 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.7 t -72.36 -47.81 50.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 116.203 -0.453 . . . . 73.409999999999997 111.928 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -68.51 -28.09 66.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.02 0.438 . . . . 73.400000000000006 111.166 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -55.38 -50.84 68.67 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.022 -0.536 . . . . 64.409999999999997 110.866 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.58 -25.97 24.7 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.124 -0.489 . . . . 61.509999999999998 111.922 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 77.8 t60 71.31 106.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.83 0.852 . . . . 61.210000000000001 112.242 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 51.7 t . . . . . 0 CA--C 1.543 0.694 0 CA-C-N 115.977 -0.556 . . . . 73.439999999999998 110.925 177.809 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.0 t70 . . . . . 0 CA--C 1.545 0.788 0 CA-C-O 121.15 0.5 . . . . 74.299999999999997 111.553 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -58.97 -43.28 91.34 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.139 0.495 . . . . 74.5 111.481 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.9 tp -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.98 -0.555 . . . . 74.209999999999994 111.084 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -62.01 -43.34 99.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.168 -0.469 . . . . 74.010000000000005 110.952 176.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' ARG . 16.5 mmt180 -69.08 -39.43 79.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.472 0.545 . . . . 64.030000000000001 112.472 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -60.84 -49.54 77.08 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.12 0.486 . . . . 71.319999999999993 110.742 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.8 m -61.89 -47.31 85.56 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.079 -0.51 . . . . 75.319999999999993 111.117 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.47 -37.8 79.14 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.395 -0.366 . . . . 63.32 111.225 177.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.72 -53.68 55.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.332 0.587 . . . . 61.130000000000003 110.763 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -63.77 -49.77 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.662 -0.699 . . . . 75.230000000000004 111.754 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.3 mt -63.72 -52.12 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 112.146 0.425 . . . . 71.239999999999995 112.146 -177.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.6 t -57.17 -48.37 78.89 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-O 120.964 0.411 . . . . 72.140000000000001 111.843 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.3 mtp180 -63.4 -40.3 96.84 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.308 -0.405 . . . . 74.140000000000001 111.629 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -60.29 -53.33 58.9 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.869 0.366 . . . . 74.319999999999993 111.089 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.7 mp -54.92 -39.95 69.34 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.743 0.306 . . . . 65.040000000000006 111.293 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -57.22 10.78 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.546 -0.297 . . . . 65.420000000000002 111.662 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -61.48 -32.38 72.38 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.0 0.428 . . . . 72.219999999999999 111.285 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.423 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 25.4 mm-40 -65.85 -33.98 77.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.176 -0.466 . . . . 72.019999999999996 111.852 175.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.98 -41.1 71.45 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.912 0.386 . . . . 71.329999999999998 111.433 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.9 p -86.96 -20.75 26.85 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.004 0.43 . . . . 54.350000000000001 111.84 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.65 0 C-N-CA 121.294 -0.479 . . . . 75.010000000000005 112.591 -177.345 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.235 0 N-CA-C 114.633 0.613 . . . . 72.140000000000001 114.633 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.79 73.35 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.931 0.715 . . . . 43.219999999999999 112.931 -173.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.0 m -54.29 -51.23 65.27 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.129 0.49 . . . . 73.200000000000003 111.581 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 66.8 m -63.6 -35.5 80.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.076 -0.511 . . . . 73.310000000000002 111.981 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.436 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 61.3 ttt180 -66.04 -55.79 14.84 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.83 0.348 . . . . 75.430000000000007 111.066 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE2' HG11 ' A' ' 147' ' ' VAL . 59.0 mtpt -55.95 -42.29 75.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.085 -0.507 . . . . 71.129999999999995 111.352 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.63 -45.57 91.6 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.319 -0.401 . . . . 61.340000000000003 111.287 174.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.07 -54.85 35.6 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.892 0.377 . . . . 63.340000000000003 111.977 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -66.87 -30.79 71.04 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.919 0.34 . . . . 73.230000000000004 111.919 -178.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.552 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -69.72 -40.91 75.97 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.093 -0.38 . . . . 64.129999999999995 110.748 174.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.2 mt -53.99 -37.29 63.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.217 0.532 . . . . 74.400000000000006 110.595 171.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -68.18 -52.75 30.95 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.146 -0.479 . . . . 72.099999999999994 111.712 175.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.545 ' NE ' ' HA ' ' A' ' 43' ' ' THR . 3.2 ptp180 -66.24 -21.65 66.3 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.634 0.605 . . . . 61.030000000000001 112.634 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 43' ' ' THR . 23.3 m -110.09 -33.79 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 122.057 -0.402 . . . . 72.209999999999994 111.885 176.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.43 -32.57 71.77 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 121.5 -0.381 . . . . 61.450000000000003 113.947 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 28.3 t70 -61.9 -52.15 65.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 117.401 0.601 . . . . 74.019999999999996 110.757 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.41 -41.53 95.27 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.47 -0.395 . . . . 65.329999999999998 112.977 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.439 ' HA ' HD21 ' A' ' 54' ' ' ASN . 69.8 t -59.89 -49.65 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 120.8 0.333 . . . . 74.230000000000004 111.084 175.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 44.5 mt-30 -57.16 -35.98 70.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.585 -0.28 . . . . 52.030000000000001 111.508 177.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.4 mmm180 -58.01 -59.76 4.78 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.795 0.331 . . . . 42.149999999999999 111.872 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.439 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.8 p30 -74.93 -19.29 60.19 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.095 0.406 . . . . 73.329999999999998 112.095 -176.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.471 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 37.8 m-70 -90.99 -22.81 20.62 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.529 0.566 . . . . 71.530000000000001 112.529 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.49 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 30.0 tt0 -54.56 -51.75 64.24 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.787 0.327 . . . . 64.519999999999996 111.818 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -53.37 -29.88 36.76 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.096 0.474 . . . . 73.439999999999998 111.771 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.48 -53.86 5.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.073 0.463 . . . . 73.099999999999994 111.556 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 15.1 m-85 -58.94 -30.01 67.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.498 0.555 . . . . 74.340000000000003 112.498 -177.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -51.16 -40.98 59.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 120.956 0.408 . . . . 75.25 111.404 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.469 ' HA2' ' CZ ' ' A' ' 64' ' ' ARG . . . -61.96 -28.41 70.31 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 121.203 -0.523 . . . . 75.140000000000001 113.158 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 81.1 mtp -89.51 -33.23 16.84 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.378 0.608 . . . . 71.329999999999998 110.335 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.0 tp -63.46 -41.37 98.61 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.744 -0.662 . . . . 62.539999999999999 111.449 -176.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.469 ' CZ ' ' HA2' ' A' ' 61' ' ' GLY . 13.3 ptt180 -67.84 -26.0 65.83 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.267 -0.424 . . . . 74.530000000000001 111.196 176.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.14 -32.66 56.5 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.069 0.462 . . . . 73.420000000000002 111.256 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.75 -73.13 0.41 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.075 -0.511 . . . . 72.299999999999997 111.531 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.1 t70 45.35 83.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.438 0.637 . . . . 64.5 111.735 -175.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.0 mp -64.95 114.62 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 115.9 -0.591 . . . . 64.150000000000006 112.17 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.481 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -103.89 -8.06 19.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 111.872 0.323 . . . . 61.130000000000003 111.872 175.389 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.481 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.6 170.39 14.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.795 0.331 . . . . 60.520000000000003 111.738 175.12 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HG2' ' HE2' ' A' ' 75' ' ' LYS . 42.5 tt0 -57.22 -28.55 62.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.315 0.487 . . . . 63.350000000000001 112.315 -177.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.98 -39.8 75.32 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 122.183 -0.323 . . . . 70.25 111.768 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 33.5 m-20 -60.97 -43.09 99.26 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.499 0.666 . . . . 74.420000000000002 109.742 175.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 121' ' ' LEU . 69.4 t -58.87 -38.29 72.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.301 -0.863 . . . . 74.340000000000003 111.561 175.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.414 ' HE2' ' HG2' ' A' ' 71' ' ' GLU . 74.5 mmtt -64.7 -40.77 95.94 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.992 0.425 . . . . 71.150000000000006 110.729 176.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 t -64.61 -33.82 76.81 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.26 -0.427 . . . . 73.230000000000004 111.136 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.7 mt -55.82 -33.34 64.37 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.499 -0.319 . . . . 73.510000000000005 111.712 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.3 t -54.7 -39.47 68.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.864 0.364 . . . . 73.239999999999995 111.123 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.418 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 23.9 mmt180 -58.86 -47.58 84.39 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.281 -0.418 . . . . 65.230000000000004 111.375 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.34 -40.71 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.066 0.46 . . . . 75.230000000000004 111.112 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.516 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.1 mmt -57.82 -40.27 79.59 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.973 -0.558 . . . . 75.349999999999994 111.565 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 75.9 mt -57.78 -37.1 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 121.081 0.467 . . . . 55.420000000000002 111.085 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.418 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 71.4 m-70 -72.29 -27.51 62.51 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.414 -0.357 . . . . 74.340000000000003 111.631 177.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 84.9 t -57.45 -38.36 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 120.907 0.384 . . . . 60.219999999999999 111.26 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.446 ' CE2' HD22 ' A' ' 98' ' ' LEU . 39.6 m-85 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 112.547 0.573 . . . . 74.420000000000002 112.547 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.3 m95 . . . . . 0 CA--C 1.552 1.046 0 N-CA-C 112.92 0.711 . . . . 73.140000000000001 112.92 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.63 55.65 Favored Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.998 -0.439 . . . . 61.32 113.072 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.789 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 1.1 mmp_? -62.73 -34.59 77.49 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.535 -0.391 . . . . 60.130000000000003 111.275 174.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.3 mm -61.93 -45.94 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.207 0.527 . . . . 51.149999999999999 109.876 174.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.0 t -57.71 -42.96 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.746 -0.661 . . . . 45.130000000000003 110.967 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.4 m -57.7 -48.2 80.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.382 -0.372 . . . . 65.129999999999995 111.137 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.517 ' HG ' HG23 ' A' ' 125' ' ' ILE . 37.3 tp -60.02 -54.39 46.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.152 0.501 . . . . 71.319999999999993 111.847 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.6 mt -69.62 -34.19 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 CA-C-N 116.284 -0.416 . . . . 63.5 111.921 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.553 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 97.3 p -63.83 -47.37 81.04 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.397 -0.189 . . . . 74.549999999999997 111.437 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 24.5 t80 -59.7 -41.14 90.1 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.797 0.332 . . . . 74.420000000000002 110.833 176.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.64 -45.12 95.14 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.872 -0.68 . . . . 73.230000000000004 112.452 175.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB1' ' HG3' ' A' ' 20' ' ' GLN . . . -65.41 -34.6 78.67 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.178 0.514 . . . . 72.329999999999998 111.465 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 58.5 t80 -63.13 -48.35 78.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.895 -0.593 . . . . 74.439999999999998 111.321 175.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 101' ' ' PHE . 52.7 t -66.76 -37.36 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.622 -0.263 . . . . 75.540000000000006 110.824 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.38 -44.01 68.29 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.992 0.425 . . . . 64.420000000000002 111.428 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -55.12 -47.4 75.08 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.157 0.503 . . . . 62.109999999999999 110.956 173.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.455 ' O ' HG12 ' A' ' 112' ' ' ILE . 64.8 t60 -65.45 -34.02 77.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 111.586 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 86.7 mt -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.52 0.2 . . . . 74.209999999999994 111.084 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -59.27 -41.75 89.59 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.033 0.444 . . . . 62.409999999999997 110.479 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 61.1 m -54.05 -45.52 71.69 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.92 -0.582 . . . . 64.120000000000005 111.83 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -93.63 17.46 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 112.097 0.406 . . . . 41.310000000000002 112.097 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 71.48 6.62 5.79 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.367 0.877 . . . . 72.340000000000003 113.367 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -81.7 45.42 0.89 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.886 0.374 . . . . 74.219999999999999 111.389 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -55.54 -43.02 75.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.994 0.518 . . . . 74.420000000000002 111.573 -176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.7 p -62.38 -34.56 76.94 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.418 -0.355 . . . . 71.519999999999996 111.938 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.2 m -59.43 -26.0 64.81 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.446 0.536 . . . . 75.540000000000006 112.446 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.2 mt -53.87 -39.57 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 112.437 0.532 . . . . 62.200000000000003 112.437 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.1 -56.77 10.37 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.752 0.649 . . . . 73.120000000000005 112.752 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.3 -28.52 72.33 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 121.714 1.609 . . . . 73.540000000000006 112.289 176.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.487 ' HA ' HG13 ' A' ' 74' ' ' VAL . 6.4 tt -66.3 -46.58 76.47 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.958 0.409 . . . . 75.25 110.071 174.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.252 -0.431 . . . . 62.409999999999997 111.326 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.17 -47.06 81.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.301 -0.409 . . . . 74.530000000000001 111.079 175.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.5 m -55.81 -44.36 77.79 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 120.873 0.368 . . . . 53.420000000000002 111.23 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.517 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.9 mm -59.57 -53.5 47.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.172 0.511 . . . . 53.409999999999997 111.136 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.8 m -63.0 -36.09 82.41 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.892 -0.594 . . . . 75.549999999999997 111.584 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 28.5 t70 -61.08 -52.32 65.4 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.517 -0.31 . . . . 74.040000000000006 111.389 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 81' ' ' MET . 61.5 t -64.43 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.187 0.518 . . . . 73.510000000000005 110.972 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.544 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.5 tp -55.99 -52.85 62.71 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.765 -0.652 . . . . 71.530000000000001 111.067 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 58.7 t -76.09 -24.26 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 115.944 -0.571 . . . . 75.349999999999994 111.512 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.9 tpt180 -57.36 -45.55 84.26 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.246 0.461 . . . . 73.439999999999998 112.246 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' HD2' ' A' ' 133' ' ' LYS . 2.4 t -114.86 -30.75 6.33 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.906 1.076 . . . . 65.430000000000007 113.906 -172.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.436 ' HD2' ' C ' ' A' ' 132' ' ' THR . 13.2 mptt -116.88 29.78 7.72 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.086 0.773 . . . . 72.200000000000003 113.086 -176.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.513 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 58.2 ttp180 -60.92 -54.6 43.09 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 120.919 0.39 . . . . 75.430000000000007 111.877 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -59.68 -36.74 77.08 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.226 -0.443 . . . . 54.109999999999999 111.542 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -69.71 -36.82 76.24 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.752 0.279 . . . . 74.239999999999995 111.752 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 129' ' ' LEU . 38.2 mt -57.47 -44.97 85.3 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 111.721 0.267 . . . . 70.120000000000005 111.721 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.0 p -78.25 -43.23 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 112.364 0.505 . . . . 63.340000000000003 112.364 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -68.59 -36.74 79.12 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.834 0.679 . . . . 74.120000000000005 112.834 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -101.13 3.23 40.99 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.178 -0.327 . . . . 74.510000000000005 111.531 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 49.65 63.97 1.95 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.043 0.449 . . . . 74.549999999999997 110.574 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.09 -47.01 6.46 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 115.114 0.806 . . . . 75.200000000000003 115.114 -171.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -75.09 -20.59 59.41 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.676 0.621 . . . . 62.109999999999999 112.676 -175.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -84.44 -51.44 6.93 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.054 0.454 . . . . 75.430000000000007 110.466 170.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.568 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.91 -32.45 66.35 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.902 -0.59 . . . . 71.430000000000007 113.012 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -58.22 -39.91 80.31 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.148 0.499 . . . . 73.329999999999998 110.983 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE2' ' A' ' 39' ' ' LYS . 60.4 t -73.16 -40.46 57.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 116.12 -0.491 . . . . 60.009999999999998 111.774 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.568 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 13.7 pt-20 -73.39 -33.85 65.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 111.897 0.332 . . . . 71.239999999999995 111.897 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.53 -45.72 92.81 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 62.329999999999998 111.603 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -82.3 -9.94 59.29 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.821 0.343 . . . . 73.340000000000003 111.311 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 54.78 86.71 0.05 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.687 0.756 . . . . 73.450000000000003 111.774 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 74.8 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.24 -0.891 . . . . 74.219999999999999 111.819 -174.533 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 . . . . . 0 C--O 1.236 0.371 0 N-CA-C 110.294 -0.262 . . . . 75.010000000000005 110.294 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 -38.35 53.04 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.465 0.65 . . . . 65.549999999999997 111.055 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.436 HD21 ' CB ' ' A' ' 137' ' ' LEU . 63.3 tp -68.82 -35.79 77.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.404 -0.816 . . . . 54.409999999999997 112.13 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -69.8 -43.85 71.24 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.981 0.419 . . . . 73.239999999999995 110.175 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -59.62 -51.69 68.75 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.048 -0.524 . . . . 61.0 111.418 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -61.57 -52.2 65.41 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.73 0.3 . . . . 61.210000000000001 111.75 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.4 m -56.33 -45.48 80.32 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.684 0.278 . . . . 75.219999999999999 111.098 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.66 -41.51 95.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.701 0.286 . . . . 75.519999999999996 111.279 176.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -60.58 -48.49 81.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.039 0.447 . . . . 71.519999999999996 110.748 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.77 -54.12 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 121.109 0.48 . . . . 74.340000000000003 111.616 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.476 ' O ' HD13 ' A' ' 17' ' ' LEU . 88.8 mt -61.21 -52.02 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.034 -0.53 . . . . 71.239999999999995 111.68 -178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.8 t -53.58 -47.53 70.03 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.824 0.345 . . . . 71.430000000000007 111.197 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 11.1 mtp180 -56.2 -55.62 30.9 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.379 -0.373 . . . . 51.409999999999997 111.568 176.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -54.83 -43.78 73.32 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.674 0.274 . . . . 75.540000000000006 111.473 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.528 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.8 mp -59.95 -43.54 94.96 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.756 0.313 . . . . 64.019999999999996 111.204 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.65 -50.41 67.2 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.798 0.333 . . . . 64.140000000000001 111.619 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 25.9 mt-10 -60.44 -38.63 84.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.056 0.455 . . . . 62.210000000000001 111.388 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 29.0 mm-40 -69.83 -46.1 66.38 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.312 -0.403 . . . . 73.319999999999993 111.889 176.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.7 81.22 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.1 0.407 . . . . 71.549999999999997 112.1 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.7 p -87.45 -28.22 22.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.707 0.289 . . . . 60.399999999999999 111.77 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.764 0 C-N-CA 121.082 -0.58 . . . . 53.32 112.682 -178.658 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.771 0 N-CA-C 113.718 0.247 . . . . 72.200000000000003 113.718 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -49.21 71.15 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 111.842 0.312 . . . . 71.230000000000004 111.842 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.7 m -54.63 -46.81 73.98 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.745 0.307 . . . . 72.340000000000003 111.806 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.7 m -65.02 -35.63 81.8 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.633 0.254 . . . . 63.420000000000002 111.579 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.452 ' NH1' ' HB3' ' A' ' 42' ' ' GLU . 18.1 tpt85 -64.81 -50.47 66.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.818 0.342 . . . . 61.149999999999999 110.663 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -59.69 -43.63 93.98 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.809 -0.632 . . . . 72.420000000000002 111.35 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.14 81.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.97 0.414 . . . . 73.420000000000002 111.215 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HG ' HH21 ' A' ' 45' ' ' ARG . 49.0 tp -61.49 -36.76 81.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.277 -0.419 . . . . 63.020000000000003 111.852 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HB3' ' NH1' ' A' ' 38' ' ' ARG . 15.8 pt-20 -78.99 -37.8 38.35 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.134 -0.354 . . . . 75.450000000000003 111.137 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.526 HG23 HG21 ' A' ' 152' ' ' VAL . 95.4 m -63.12 -35.23 79.58 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.893 0.378 . . . . 74.299999999999997 110.808 175.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -56.81 -32.76 66.04 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.983 0.421 . . . . 61.310000000000002 111.161 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.439 HH22 ' CD ' ' A' ' 19' ' ' GLU . 32.2 mtt-85 -79.07 -43.72 23.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.078 0.466 . . . . 75.230000000000004 110.415 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -44.8 59.84 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.588 -0.733 . . . . 75.510000000000005 112.324 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 34.0 m -106.81 -34.49 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 112.267 0.469 . . . . 71.019999999999996 112.267 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.78 -39.64 97.73 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.28 -0.486 . . . . 61.509999999999998 113.473 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.35 -56.33 23.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.936 0.398 . . . . 74.319999999999993 110.974 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.38 -48.17 77.59 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-N 116.034 -0.53 . . . . 73.420000000000002 112.797 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.4 t -57.45 -50.86 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 O-C-N 122.851 -0.205 . . . . 75.129999999999995 111.216 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -53.84 -46.91 71.34 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.689 0.255 . . . . 72.510000000000005 111.689 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -60.86 -45.69 93.55 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.857 0.688 . . . . 71.019999999999996 112.857 -176.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -84.76 -21.2 30.08 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.692 -0.63 . . . . 54.109999999999999 112.052 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -90.4 -18.29 25.71 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.322 0.489 . . . . 74.530000000000001 112.322 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 40.6 tt0 -49.07 -46.04 43.91 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.558 0.577 . . . . 74.340000000000003 112.558 -174.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.2 t -56.17 -35.28 67.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.907 0.384 . . . . 32.420000000000002 111.965 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.57 -44.01 21.9 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.811 0.338 . . . . 72.239999999999995 111.737 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -59.9 -47.33 86.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.605 -0.27 . . . . 64.329999999999998 111.35 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.483 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 75.4 mm-40 -53.15 -38.19 62.49 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.87 0.367 . . . . 61.219999999999999 111.028 176.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.24 -41.21 86.31 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.03 -0.605 . . . . 64.439999999999998 112.313 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 39.9 mtm -72.78 -34.13 66.73 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.483 -0.422 . . . . 72.510000000000005 111.148 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.0 -33.62 73.54 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.647 0.261 . . . . 75.140000000000001 110.916 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 47.3 mtm180 -68.83 -17.3 63.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.156 0.503 . . . . 70.209999999999994 111.239 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -95.6 -20.35 19.04 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 72.239999999999995 110.917 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.6 mt -99.83 -82.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.06 -0.518 . . . . 51.109999999999999 111.865 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.7 t0 48.63 98.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.702 0.763 . . . . 63.210000000000001 111.97 -172.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.459 ' N ' HD12 ' A' ' 68' ' ' ILE . 1.6 mp -76.32 123.81 33.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 115.614 -0.721 . . . . 74.0 111.904 -175.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -113.25 -5.55 13.63 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.22 0.452 . . . . 52.43 112.22 177.148 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.417 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -167.35 174.14 8.28 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.924 0.392 . . . . 71.430000000000007 111.625 173.379 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.08 -38.91 58.79 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.434 0.531 . . . . 74.150000000000006 112.434 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -51.3 -41.79 60.74 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.241 0.459 . . . . 75.239999999999995 112.241 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.451 ' HB2' HG23 ' A' ' 68' ' ' ILE . 20.5 m-20 -63.21 -43.11 99.04 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.889 0.376 . . . . 70.400000000000006 110.647 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.527 HG21 ' HB3' ' A' ' 117' ' ' SER . 72.6 t -56.38 -43.43 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.92 -0.582 . . . . 73.349999999999994 110.993 177.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -73.07 -29.38 62.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.186 -0.461 . . . . 64.439999999999998 111.511 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.8 m -68.39 -28.67 67.31 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.933 0.397 . . . . 41.420000000000002 110.851 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 86.7 mt -55.67 -28.38 55.18 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.339 -0.391 . . . . 74.209999999999994 111.452 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 82' ' ' ILE . 81.3 p -52.13 -35.27 47.85 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 120.798 0.333 . . . . 74.120000000000005 111.373 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -61.75 -45.55 93.42 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.99 0.424 . . . . 52.450000000000003 110.713 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 82.4 t -64.16 -42.79 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.141 0.496 . . . . 74.030000000000001 110.354 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.472 ' SD ' HD12 ' A' ' 98' ' ' LEU . 21.7 mmt -56.17 -38.93 71.59 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.709 -0.678 . . . . 70.420000000000002 111.673 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 78' ' ' SER . 85.0 mt -64.37 -41.24 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.098 0.475 . . . . 74.140000000000001 110.911 174.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -64.73 -27.93 69.24 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.046 0.388 . . . . 65.340000000000003 112.046 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.0 t -55.28 -34.63 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 121.016 0.436 . . . . 44.329999999999998 111.911 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 CA--C 1.548 0.881 0 N-CA-C 112.057 0.392 . . . . 73.420000000000002 112.057 179.935 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.439 ' HE3' HG13 ' A' ' 95' ' ' ILE . 79.4 m95 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 120.964 0.411 . . . . 73.519999999999996 110.701 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.64 -41.36 99.83 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.311 -0.404 . . . . 71.340000000000003 112.589 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -51.77 -38.14 54.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.901 0.381 . . . . 75.019999999999996 111.636 171.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.439 HG13 ' HE3' ' A' ' 92' ' ' TRP . 36.9 mm -69.6 -43.21 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.987 0.423 . . . . 63.420000000000002 110.561 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.69 -53.19 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.199 -0.455 . . . . 74.140000000000001 111.029 175.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.9 m -57.79 -45.0 86.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.226 -0.443 . . . . 64.0 111.504 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 26.7 tp -57.33 -54.63 44.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.167 0.508 . . . . 54.240000000000002 111.631 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.84 -41.94 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.236 -0.438 . . . . 74.540000000000006 111.739 -178.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.9 m -63.02 -41.18 99.48 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.674 0.273 . . . . 53.229999999999997 111.391 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 105' ' ' VAL . 29.5 t80 -68.89 -40.15 79.36 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.681 0.277 . . . . 74.140000000000001 110.742 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.17 -48.01 83.24 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 120.834 -0.698 . . . . 23.219999999999999 112.221 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.528 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.9 -35.13 80.14 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.136 0.494 . . . . 62.200000000000003 111.374 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.416 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 44.2 t80 -61.83 -50.89 70.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.905 -0.588 . . . . 73.150000000000006 110.919 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 101' ' ' PHE . 59.3 t -62.33 -38.54 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 116.33 -0.395 . . . . 73.409999999999997 110.815 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.33 -41.01 71.89 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.871 0.367 . . . . 43.539999999999999 111.618 176.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 95.8 mttt -58.06 -44.87 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.057 0.456 . . . . 71.049999999999997 111.046 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.407 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -67.64 -36.46 80.83 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.346 -0.388 . . . . 75.540000000000006 111.163 177.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.48 -50.36 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.611 0.243 . . . . 72.530000000000001 111.556 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -60.92 -40.83 94.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.047 0.451 . . . . 63.240000000000002 110.712 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.1 m -58.81 -39.13 80.26 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.154 -0.475 . . . . 75.140000000000001 112.239 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.407 HG12 ' O ' ' A' ' 108' ' ' HIS . 38.5 pt -94.55 17.2 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.654 0.613 . . . . 71.340000000000003 112.654 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 71.74 12.59 6.28 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.747 0.647 . . . . 63.039999999999999 112.747 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -97.95 31.65 2.62 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.324 . . . . 74.140000000000001 111.347 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.446 ' HG3' HD12 ' A' ' 118' ' ' ILE . 38.4 tt0 -56.74 -35.64 68.84 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.196 0.443 . . . . 61.310000000000002 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.7 m -56.56 -27.51 57.93 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.026 0.441 . . . . 73.420000000000002 111.576 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.527 ' HB3' HG21 ' A' ' 74' ' ' VAL . 53.4 m -71.26 -25.82 62.63 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.405 0.521 . . . . 62.119999999999997 112.405 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.446 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.6 mt -53.59 -46.74 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 113.08 0.77 . . . . 75.120000000000005 113.08 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.58 -54.08 32.83 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 112.497 0.555 . . . . 63.299999999999997 112.497 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.19 -26.44 69.64 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.575 1.516 . . . . 71.400000000000006 112.492 174.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.425 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.4 tt -67.36 -44.65 78.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.717 -0.475 . . . . 74.530000000000001 109.717 173.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.466 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.16 -37.79 78.18 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.074 0.464 . . . . 71.430000000000007 111.099 174.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.14 -38.64 91.27 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.116 -0.493 . . . . 73.409999999999997 110.682 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.0 m -63.05 -44.17 96.58 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 120.815 0.341 . . . . 63.350000000000001 111.136 175.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 47.5 mm -56.34 -53.04 44.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.179 0.514 . . . . 71.010000000000005 110.656 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -63.7 -35.77 81.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.737 -0.665 . . . . 74.219999999999999 111.55 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 27.0 t70 -62.88 -52.06 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.539 -0.3 . . . . 71.349999999999994 111.396 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 65.0 t -62.23 -46.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.163 0.506 . . . . 73.349999999999994 110.442 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.7 tp -49.94 -53.07 28.53 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.526 -0.761 . . . . 65.530000000000001 111.673 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.504 HG13 ' HD3' ' A' ' 134' ' ' ARG . 71.2 t -76.92 -32.94 20.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.912 -0.586 . . . . 74.409999999999997 112.166 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 16.0 tpt180 -55.26 -33.13 62.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.008 0.432 . . . . 60.439999999999998 111.738 -176.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -40.73 3.35 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.672 0.619 . . . . 64.209999999999994 112.672 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -101.9 18.94 19.32 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.48 0.918 . . . . 71.400000000000006 113.48 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.504 ' HD3' HG13 ' A' ' 130' ' ' VAL . 14.8 tpt180 -47.28 -56.37 6.91 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.591 0.589 . . . . 73.109999999999999 112.591 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.35 -42.8 58.78 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.824 0.345 . . . . 70.430000000000007 111.069 -177.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -56.43 -37.37 70.13 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.503 -0.317 . . . . 70.219999999999999 111.824 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.558 HD11 ' HG ' ' A' ' 129' ' ' LEU . 18.4 mt -55.05 -51.17 67.16 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.421 -0.354 . . . . 72.299999999999997 111.924 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.1 p -77.78 -43.06 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.631 -0.668 . . . . 70.219999999999999 112.071 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -58.72 -40.59 84.18 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.233 0.457 . . . . 73.150000000000006 112.233 -177.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -101.66 10.85 39.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.27 0.557 . . . . 72.209999999999994 110.7 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.631 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 23.0 mtm180 67.17 7.21 5.28 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.349 -0.841 . . . . 75.019999999999996 113.088 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 137' ' ' LEU . . . 32.21 -82.65 0.0 OUTLIER Glycine 0 N--CA 1.468 0.827 0 N-CA-C 115.711 1.045 . . . . 73.140000000000001 115.711 173.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.442 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.2 m95 -70.87 -46.48 62.56 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.341 0.256 . . . . 72.430000000000007 111.382 -176.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.631 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 23.7 m-20 -61.85 -39.94 93.59 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.056 0.455 . . . . 73.099999999999994 110.025 170.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.55 91.14 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 115.85 -0.614 . . . . 63.299999999999997 112.503 176.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -67.14 -44.19 80.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.074 0.55 . . . . 64.299999999999997 111.111 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 143' ' ' TRP . 94.8 t -62.96 -44.29 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 116.199 -0.455 . . . . 64.430000000000007 111.898 178.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.58 -32.07 63.94 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.675 0.274 . . . . 71.329999999999998 111.738 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -55.82 -50.42 70.58 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.954 0.407 . . . . 71.120000000000005 111.79 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.18 -14.02 45.27 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.225 -0.443 . . . . 72.450000000000003 112.098 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 57.61 79.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.198 0.599 . . . . 72.030000000000001 111.569 -173.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.526 HG21 HG23 ' A' ' 43' ' ' THR . 93.1 t . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.858 -0.61 . . . . 70.120000000000005 110.334 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 112.633 0.605 . . . . 62.030000000000001 112.633 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.08 -40.01 60.57 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.532 0.682 . . . . 72.019999999999996 110.5 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -58.05 -38.7 76.79 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 115.487 -0.779 . . . . 71.310000000000002 111.692 176.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -67.53 -41.18 84.77 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.522 -0.308 . . . . 73.219999999999999 110.581 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -53.94 -51.45 63.78 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.769 0.318 . . . . 65.439999999999998 111.439 176.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.68 -52.73 59.35 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.056 0.391 . . . . 63.310000000000002 112.056 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -57.83 -43.17 85.64 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.283 -0.417 . . . . 73.030000000000001 111.389 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.429 HD11 ' HG2' ' A' ' 123' ' ' GLU . 36.3 tp -62.21 -41.78 98.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.55 -0.296 . . . . 64.040000000000006 111.673 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -59.25 -51.61 69.22 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.897 0.379 . . . . 64.239999999999995 111.412 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.89 -52.51 48.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.201 0.524 . . . . 74.439999999999998 111.486 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.18 -42.39 88.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.921 -0.581 . . . . 74.299999999999997 111.825 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 t -59.62 -49.59 77.18 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.63 0.252 . . . . 64.450000000000003 111.587 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.461 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 67.1 mtt180 -59.23 -48.1 82.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.871 0.367 . . . . 62.5 110.685 177.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -56.82 -54.96 40.37 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.257 -0.429 . . . . 74.109999999999999 112.055 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.34 -40.21 81.55 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.791 0.293 . . . . 74.329999999999998 111.791 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -63.47 -57.5 10.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 111.907 0.336 . . . . 74.150000000000006 111.907 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.2 mm-40 -66.66 -31.32 71.93 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.937 0.399 . . . . 72.340000000000003 111.828 -177.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -76.36 -34.48 58.92 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.632 0.253 . . . . 73.239999999999995 111.423 179.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.93 -34.54 71.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.168 0.509 . . . . 43.25 110.982 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.3 p -86.95 -22.33 25.68 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.08 -0.509 . . . . 75.430000000000007 111.794 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.665 0 C-N-CA 121.319 -0.467 . . . . 55.130000000000003 112.712 -178.842 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.888 0 N-CA-C 113.505 0.162 . . . . 55.130000000000003 113.505 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.89 -38.35 70.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.464 0.542 . . . . 54.329999999999998 112.464 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.485 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 25.1 m -58.98 -48.07 82.87 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.971 0.415 . . . . 73.030000000000001 111.82 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.4 t -64.88 -43.14 93.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.972 0.415 . . . . 70.109999999999999 111.065 177.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -60.84 -54.7 41.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.267 -0.424 . . . . 65.239999999999995 112.142 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.485 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 20.8 ptmt -56.03 -41.85 75.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.559 0.218 . . . . 74.010000000000005 111.054 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.05 87.77 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.766 0.317 . . . . 73.140000000000001 111.524 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.4 tp -58.85 -54.7 44.18 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.524 0.565 . . . . 64.0 112.524 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.05 -27.75 63.87 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.105 -0.372 . . . . 64.420000000000002 111.756 -176.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.492 ' O ' HG22 ' A' ' 47' ' ' VAL . 46.8 m -62.75 -45.19 93.86 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 120.827 0.346 . . . . 73.349999999999994 110.135 171.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -54.57 -34.65 62.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.29 -0.414 . . . . 73.519999999999996 111.719 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -70.73 -52.21 22.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.785 0.326 . . . . 72.409999999999997 110.945 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -58.85 -44.27 90.95 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.15 -0.477 . . . . 74.129999999999995 112.164 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 43' ' ' THR . 19.5 m -87.98 -33.05 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 120.948 0.404 . . . . 72.010000000000005 111.942 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.02 -30.34 74.0 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 114.229 0.451 . . . . 61.119999999999997 114.229 -174.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.521 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 29.6 t70 -58.42 -57.61 12.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 117.568 0.684 . . . . 75.209999999999994 111.277 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.07 -42.08 98.3 Favored Glycine 0 CA--C 1.526 0.763 0 C-N-CA 121.353 -0.451 . . . . 55.200000000000003 113.006 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 47' ' ' VAL . 77.0 t -57.52 -45.47 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 122.593 -0.357 . . . . 73.150000000000006 111.067 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -61.27 -43.86 98.19 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.76 -0.2 . . . . 72.5 111.22 175.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 4.3 mmp_? -57.25 -49.4 76.16 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.826 0.346 . . . . 75.239999999999995 111.494 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -66.17 -47.65 73.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.155 0.502 . . . . 64.200000000000003 111.637 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -73.05 -20.69 60.93 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.943 -0.571 . . . . 71.140000000000001 112.453 -176.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -49.1 -54.59 15.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.324 0.491 . . . . 74.209999999999994 112.324 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 t -53.24 -36.73 61.39 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.419 0.525 . . . . 75.329999999999998 112.419 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.08 14.81 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.014 0.435 . . . . 53.310000000000002 111.538 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -60.04 -36.57 77.57 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.342 -0.39 . . . . 73.120000000000005 111.882 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.532 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 70.7 mm-40 -47.13 -50.99 19.17 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 120.985 0.421 . . . . 53.240000000000002 111.254 176.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.78 -35.47 67.98 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.098 -0.501 . . . . 75.439999999999998 113.208 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 45.0 mtm -77.15 -44.59 29.75 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 122.301 -0.529 . . . . 60.240000000000002 111.143 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 105' ' ' VAL . 9.1 mp -54.88 -27.73 44.96 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.132 -0.355 . . . . 72.109999999999999 111.416 176.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 99.4 mtt180 -65.02 -44.72 88.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.749 0.309 . . . . 73.239999999999995 111.562 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.69 -7.07 55.42 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.344 0.498 . . . . 70.340000000000003 112.344 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.404 HD13 HD21 ' A' ' 77' ' ' LEU . 96.1 mt -96.35 -71.66 0.67 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.052 0.453 . . . . 74.040000000000006 111.209 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t0 47.46 88.85 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.248 -0.887 . . . . 72.319999999999993 111.838 -172.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.523 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -73.22 103.09 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.914 -0.584 . . . . 55.140000000000001 111.053 -178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.428 ' HD3' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.09 -11.3 16.66 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.101 0.408 . . . . 75.030000000000001 112.101 -179.294 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.428 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 1.2 p30 -154.42 176.79 11.91 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.024 0.44 . . . . 72.519999999999996 111.978 178.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.1 -39.72 79.36 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.163 -0.471 . . . . 74.120000000000005 112.119 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -56.1 -39.87 72.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.483 -0.326 . . . . 73.040000000000006 111.747 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.523 ' HB2' HG23 ' A' ' 68' ' ' ILE . 50.8 m-20 -62.23 -39.12 91.76 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.938 0.399 . . . . 73.409999999999997 110.711 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 82.2 t -60.87 -46.8 95.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.206 0.526 . . . . 65.349999999999994 110.927 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' SER . 99.7 mttt -65.91 -28.78 69.19 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.889 0.376 . . . . 61.140000000000001 111.186 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.9 m -67.55 -36.48 81.04 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.791 0.329 . . . . 51.119999999999997 110.492 171.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.54 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.7 mt -59.44 -39.98 85.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.668 0.27 . . . . 74.219999999999999 110.617 173.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 28.9 t -52.46 -37.02 56.07 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.96 0.409 . . . . 43.229999999999997 111.225 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -61.37 -47.27 86.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.947 0.403 . . . . 64.150000000000006 110.361 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' HG23 ' A' ' 84' ' ' VAL . 59.7 t -60.89 -42.86 94.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.263 -0.426 . . . . 75.310000000000002 110.892 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -54.54 -44.14 72.57 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.131 -0.486 . . . . 64.450000000000003 111.238 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 78' ' ' SER . 74.9 mt -61.79 -36.9 76.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.146 0.498 . . . . 64.120000000000005 111.137 176.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -71.65 -27.47 63.1 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.073 0.397 . . . . 64.530000000000001 112.073 178.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 80' ' ' VAL . 94.1 t -58.82 -23.84 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 N-CA-C 111.994 0.368 . . . . 73.25 111.994 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.469 ' CE2' HD22 ' A' ' 98' ' ' LEU . 58.0 m-85 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.437 0.532 . . . . 62.130000000000003 112.437 178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.4 m95 . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.285 0.476 . . . . 74.409999999999997 112.285 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.47 -27.81 54.61 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 120.978 -0.63 . . . . 70.239999999999995 113.506 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.9 mtp85 -65.8 -25.64 67.33 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.52 -0.4 . . . . 74.439999999999998 112.0 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.4 mm -57.03 -40.75 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 121.247 0.546 . . . . 71.430000000000007 110.16 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.42 -41.45 88.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 116.031 -0.531 . . . . 64.319999999999993 110.886 176.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.6 m -57.86 -44.26 86.48 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.859 0.361 . . . . 64.040000000000006 111.233 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CE2' ' A' ' 85' ' ' PHE . 31.5 tp -61.39 -54.94 37.19 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.184 0.516 . . . . 70.109999999999999 111.693 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.37 -37.01 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.136 -0.484 . . . . 75.099999999999994 112.193 -176.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.6 p -64.05 -41.88 97.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.653 -0.249 . . . . 72.450000000000003 111.282 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 16.0 t80 -60.17 -43.48 95.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.921 0.391 . . . . 62.109999999999999 110.577 175.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.72 -46.42 92.26 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.969 -0.634 . . . . 51.310000000000002 112.552 174.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.13 80.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.941 0.401 . . . . 71.329999999999998 111.682 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -65.59 -47.98 73.9 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.267 -0.424 . . . . 70.040000000000006 111.025 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 101' ' ' PHE . 41.6 t -64.92 -34.24 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.93 0.395 . . . . 74.329999999999998 110.546 176.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.09 -39.91 79.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.134 -0.485 . . . . 65.530000000000001 111.405 176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.25 -46.2 83.26 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.15 0.5 . . . . 72.239999999999995 110.906 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -62.3 -35.8 80.14 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.988 -0.551 . . . . 71.230000000000004 110.937 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.56 HD13 ' HB2' ' A' ' 117' ' ' SER . 98.4 mt -65.29 -45.0 86.18 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.259 -0.428 . . . . 73.420000000000002 111.198 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -57.53 -43.57 84.46 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.534 0.207 . . . . 62.409999999999997 111.081 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.5 m -54.65 -48.42 72.34 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.988 0.423 . . . . 73.239999999999995 111.505 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.8 pt -90.02 17.53 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 112.159 0.429 . . . . 64.230000000000004 112.159 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 67.69 9.11 6.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.701 1.0 . . . . 72.239999999999995 113.701 174.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.52 43.56 1.12 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.83 -0.544 . . . . 61.299999999999997 111.76 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.15 -28.98 70.03 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 122.167 -0.333 . . . . 65.319999999999993 111.655 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.0 m -56.41 -27.76 57.41 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.764 0.316 . . . . 73.310000000000002 111.499 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.56 ' HB2' HD13 ' A' ' 109' ' ' LEU . 43.9 m -74.43 -26.78 60.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.107 0.41 . . . . 65.120000000000005 112.107 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.93 -45.43 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 112.994 0.739 . . . . 62.340000000000003 112.994 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.84 -51.48 19.89 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.659 0.615 . . . . 73.409999999999997 112.659 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.28 -28.69 85.38 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.638 1.559 . . . . 75.140000000000001 111.936 172.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.04 -45.02 82.93 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 109.539 -0.541 . . . . 72.150000000000006 109.539 173.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.18 82.99 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.057 0.456 . . . . 71.150000000000006 110.905 173.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.429 ' HG2' HD11 ' A' ' 10' ' ' LEU . 40.9 mt-10 -66.23 -32.56 74.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.365 -0.38 . . . . 64.510000000000005 111.013 174.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.1 m -65.01 -46.25 82.16 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.946 0.403 . . . . 64.450000000000003 110.863 175.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.419 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.1 mm -56.26 -50.76 69.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.427 0.632 . . . . 51.439999999999998 110.642 175.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.2 m -64.24 -41.2 97.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.399 -0.819 . . . . 55.219999999999999 111.748 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.1 t70 -60.65 -52.01 66.95 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.542 -0.299 . . . . 65.200000000000003 110.692 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 81' ' ' MET . 93.2 t -58.04 -44.63 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 121.113 0.482 . . . . 73.25 111.252 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 137' ' ' LEU . 14.0 tp -55.35 -51.98 65.01 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.4 0.619 . . . . 64.140000000000001 110.85 178.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 134' ' ' ARG . 90.3 t -75.5 -26.38 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.728 -0.669 . . . . 54.049999999999997 112.032 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.3 tpp180 -61.46 -35.27 77.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.924 0.392 . . . . 73.010000000000005 111.969 -176.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.7 t -121.79 -33.19 3.62 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.801 0.667 . . . . 63.109999999999999 112.801 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.515 ' HG2' HG23 ' A' ' 132' ' ' THR . 46.4 mmtm -114.72 20.53 15.17 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.262 0.838 . . . . 73.299999999999997 113.262 -172.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.418 ' HB2' HG13 ' A' ' 130' ' ' VAL . 44.1 ttp180 -56.41 -51.67 67.49 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.089 0.471 . . . . 71.430000000000007 111.637 177.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.66 -47.33 84.81 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.922 -0.581 . . . . 71.109999999999999 111.123 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -61.67 -37.15 83.02 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 111.611 0.226 . . . . 71.510000000000005 111.611 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 129' ' ' LEU . 20.7 mt -58.29 -48.07 81.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.645 -0.252 . . . . 73.340000000000003 111.672 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.6 p -78.34 -39.66 24.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 112.161 0.43 . . . . 74.420000000000002 112.161 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -67.03 -49.7 64.4 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.413 0.523 . . . . 73.140000000000001 112.413 -177.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -94.6 -1.35 53.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.698 0.285 . . . . 75.329999999999998 111.482 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 55.63 79.02 0.17 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.406 0.622 . . . . 75.319999999999993 111.078 -177.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -54.47 -53.28 39.46 Favored Glycine 0 C--N 1.335 0.478 0 CA-C-N 115.244 -0.889 . . . . 64.310000000000002 114.28 -173.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -65.55 -40.03 92.38 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.132 0.466 . . . . 75.239999999999995 111.88 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 6.4 m-20 -62.2 -58.55 7.34 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.829 0.347 . . . . 75.120000000000005 110.866 175.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -59.02 -31.19 68.04 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 121.329 -0.462 . . . . 45.219999999999999 112.831 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -58.88 -55.73 31.34 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.167 0.508 . . . . 74.120000000000005 111.119 175.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.485 HG21 ' HG3' ' A' ' 39' ' ' LYS . 93.5 t -63.85 -36.83 77.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 116.147 -0.479 . . . . 64.510000000000005 111.568 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 55.1 mt-10 -66.82 -39.14 87.58 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.93 0.395 . . . . 73.340000000000003 111.236 176.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -61.32 -48.97 78.9 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.903 0.383 . . . . 73.319999999999993 111.788 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.46 -22.53 35.16 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.011 0.374 . . . . 63.439999999999998 112.011 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.1 t60 61.08 88.16 0.09 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.524 0.678 . . . . 60.299999999999997 111.044 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.476 HG21 HG23 ' A' ' 43' ' ' THR . 76.8 t . . . . . 0 N--CA 1.467 0.378 0 CA-C-N 115.717 -0.674 . . . . 62.119999999999997 110.689 178.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 t70 . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 108.873 -0.788 . . . . 74.519999999999996 108.873 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -61.28 -33.69 73.96 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.386 -0.821 . . . . 61.219999999999999 111.413 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.48 -35.39 75.78 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.088 0.47 . . . . 60.119999999999997 110.497 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -67.27 -36.15 81.0 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.046 -0.525 . . . . 74.230000000000004 110.24 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.488 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 4.4 mpt_? -61.98 -51.26 68.79 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.639 -0.255 . . . . 71.140000000000001 111.544 176.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.41 -48.01 83.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.018 0.437 . . . . 73.450000000000003 111.75 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 p -60.67 -52.81 63.57 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.389 -0.369 . . . . 51.240000000000002 111.344 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.9 tp -58.78 -35.96 73.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.008 0.433 . . . . 60.340000000000003 111.615 176.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 21.3 tt0 -59.27 -52.93 63.53 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.274 0.559 . . . . 75.310000000000002 110.619 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -63.85 -53.96 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 115.646 -0.707 . . . . 74.409999999999997 111.774 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.465 ' O ' HD13 ' A' ' 17' ' ' LEU . 82.8 mt -59.16 -49.85 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 112.17 0.433 . . . . 74.150000000000006 112.17 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.7 t -55.16 -50.26 69.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 120.853 0.359 . . . . 71.230000000000004 111.524 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -60.86 -42.78 98.54 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.636 -0.256 . . . . 72.099999999999994 111.593 178.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 85.1 t80 -58.48 -52.86 63.87 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.896 0.379 . . . . 75.420000000000002 111.765 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -54.47 -41.2 69.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.879 0.371 . . . . 60.350000000000001 111.581 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.434 ' NH2' ' HG3' ' A' ' 119' ' ' GLU . 19.4 mmt85 -65.2 -52.78 52.72 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.352 0.501 . . . . 65.230000000000004 112.352 178.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -62.39 -34.27 76.38 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.846 0.355 . . . . 75.129999999999995 111.955 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 33.3 mm-40 -69.64 -32.02 70.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.882 0.372 . . . . 73.109999999999999 111.208 176.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.52 -29.65 61.48 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.37 -0.377 . . . . 71.219999999999999 111.921 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.528 HG22 ' HE3' ' A' ' 110' ' ' LYS . 51.5 p -87.17 -30.43 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.826 0.346 . . . . 65.140000000000001 111.753 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.755 0 C-N-CA 121.26 -0.495 . . . . 72.340000000000003 112.399 -176.281 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.041 0 N-CA-C 113.93 0.332 . . . . 74.230000000000004 113.93 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.48 -50.83 69.85 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.917 0.71 . . . . 62.409999999999997 112.917 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.8 m -57.77 -50.76 72.16 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.169 0.433 . . . . 72.019999999999996 112.169 -177.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 79.8 p -57.78 -48.06 80.77 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.566 -0.288 . . . . 73.430000000000007 111.703 178.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.0 ttt-85 -52.97 -54.66 31.84 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.913 0.387 . . . . 71.439999999999998 111.288 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -55.86 -48.64 75.17 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.921 -0.582 . . . . 62.200000000000003 111.161 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.35 -41.34 98.84 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.273 -0.421 . . . . 71.219999999999999 111.829 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.24 -53.39 49.93 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 111.775 0.287 . . . . 71.510000000000005 111.775 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -64.35 -31.34 72.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.771 0.32 . . . . 72.349999999999994 111.409 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.5 ' O ' HG22 ' A' ' 47' ' ' VAL . 86.2 m -67.17 -44.15 80.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.778 0.323 . . . . 62.039999999999999 110.57 174.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 39.2 mt -54.9 -44.19 73.93 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.495 0.554 . . . . 64.120000000000005 112.495 178.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -72.25 -37.54 69.09 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.538 0.57 . . . . 72.230000000000004 112.538 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.411 ' NH1' HG13 ' A' ' 152' ' ' VAL . 16.1 ptm180 -73.77 -41.36 62.56 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.965 -0.46 . . . . 73.129999999999995 111.814 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 43' ' ' THR . 17.2 m -79.11 -33.51 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.189 0.518 . . . . 64.549999999999997 110.734 176.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -59.68 -50.33 68.91 Favored Glycine 0 C--O 1.225 -0.451 0 CA-C-N 115.74 -0.664 . . . . 50.25 112.751 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -53.87 -46.59 71.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.898 0.349 . . . . 73.340000000000003 111.51 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.08 -48.41 79.87 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 121.14 -0.552 . . . . 73.219999999999999 112.9 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 54' ' ' ASN . 70.9 t -63.52 -47.08 93.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.909 0.385 . . . . 73.0 111.378 176.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.5 mt-30 -55.18 -47.41 75.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 111.595 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -57.81 -42.0 83.35 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.11 0.781 . . . . 73.239999999999995 113.11 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -84.87 -27.58 26.59 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.821 -0.549 . . . . 70.319999999999993 111.906 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -90.72 -18.21 25.41 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.221 0.823 . . . . 74.409999999999997 113.221 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 31.7 tt0 -49.15 -51.12 34.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.862 0.689 . . . . 71.310000000000002 112.862 -170.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.71 -35.51 70.75 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.051 0.453 . . . . 44.399999999999999 111.655 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.05 -49.59 49.69 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.267 -0.424 . . . . 63.32 111.615 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.92 -40.8 98.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.697 0.258 . . . . 74.099999999999994 111.697 178.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.592 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 74.7 mm-40 -51.34 -44.7 62.09 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.597 0.237 . . . . 72.409999999999997 111.131 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.462 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -51.85 -38.72 46.32 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.229 -0.51 . . . . 61.240000000000002 112.826 176.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 84.9 mtp -73.3 -43.21 61.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 54.520000000000003 111.121 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.402 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 8.7 mp -57.46 -29.36 64.14 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.15 0.426 . . . . 75.230000000000004 112.15 178.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.592 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 53.8 mtm180 -64.51 -10.99 29.43 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.621 0.6 . . . . 74.049999999999997 112.621 -178.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -122.3 -0.74 9.29 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.009 0.433 . . . . 73.400000000000006 111.424 173.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.1 mt -97.12 -78.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.385 -0.37 . . . . 75.150000000000006 110.889 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 68.11 -47.93 0.53 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.161 1.171 . . . . 72.310000000000002 114.161 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.2 mp 65.58 114.82 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.7 0.8 . . . . 74.299999999999997 111.938 -177.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.48 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -114.54 -5.41 12.8 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.286 -0.416 . . . . 72.0 111.717 176.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.504 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -170.46 175.84 4.62 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.714 0.292 . . . . 65.530000000000001 111.341 172.615 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 37.8 tt0 -58.21 -24.04 57.82 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.995 0.369 . . . . 72.329999999999998 111.995 -178.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.428 ' HB3' HD21 ' A' ' 70' ' ' ASN . 36.9 t70 -56.01 -45.25 79.14 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.782 0.325 . . . . 71.329999999999998 111.016 176.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -63.6 -41.28 98.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.113 0.483 . . . . 65.340000000000003 110.412 175.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.0 t -56.74 -43.57 79.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 115.997 -0.547 . . . . 72.409999999999997 111.323 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 71' ' ' GLU . 65.3 mttm -60.15 -39.66 87.14 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.293 0.568 . . . . 74.099999999999994 110.564 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.1 t -66.79 -33.12 74.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.974 -0.557 . . . . 52.329999999999998 110.969 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 81' ' ' MET . 85.4 mt -61.01 -37.28 81.98 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.72 0.295 . . . . 54.119999999999997 110.798 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -52.75 -41.22 63.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.998 0.427 . . . . 72.310000000000002 111.098 177.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 79' ' ' ARG . 16.8 mmt85 -56.23 -44.58 79.7 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.164 0.507 . . . . 74.319999999999993 110.749 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.2 t -69.95 -41.08 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.782 -0.644 . . . . 70.140000000000001 111.392 178.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.463 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.5 mmt -55.54 -38.82 69.79 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.025 0.441 . . . . 71.140000000000001 111.605 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 70.9 mt -58.49 -40.72 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.248 0.547 . . . . 54.130000000000003 110.85 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.0 -25.8 60.09 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.912 -0.585 . . . . 64.450000000000003 112.47 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 94.9 t -54.0 -25.33 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-O 120.981 0.42 . . . . 75.310000000000002 111.709 175.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.614 ' HZ ' HD22 ' A' ' 98' ' ' LEU . 79.2 m-85 . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 112.474 0.546 . . . . 74.430000000000007 112.474 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.566 ' HE3' HG13 ' A' ' 95' ' ' ILE . 90.9 m95 . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 112.756 0.65 . . . . 75.140000000000001 112.756 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.24 -35.47 70.83 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 121.056 -0.592 . . . . 54.43 112.418 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.2 ptt180 -56.12 -40.49 73.83 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.865 0.466 . . . . 74.209999999999994 111.603 173.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.566 HG13 ' HE3' ' A' ' 92' ' ' TRP . 40.1 mm -67.79 -44.95 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 120.937 0.399 . . . . 73.329999999999998 110.563 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.6 t -55.06 -46.32 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 116.099 -0.5 . . . . 74.530000000000001 111.118 176.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -58.78 -46.92 86.43 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 65.319999999999993 111.597 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.614 HD22 ' HZ ' ' A' ' 85' ' ' PHE . 26.2 tp -57.76 -55.02 40.23 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.213 0.53 . . . . 75.340000000000003 111.661 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.8 mt -69.19 -35.89 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.972 -0.558 . . . . 74.230000000000004 111.912 -174.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.8 p -68.19 -43.13 78.79 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.56 0.219 . . . . 54.43 111.172 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -63.18 -42.35 99.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.775 0.321 . . . . 73.049999999999997 111.101 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.91 -48.1 84.51 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.896 -0.668 . . . . 73.340000000000003 112.158 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.427 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.41 -32.49 74.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.152 0.501 . . . . 51.140000000000001 111.353 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.466 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 39.3 t80 -63.81 -47.5 80.63 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.895 -0.593 . . . . 73.219999999999999 110.832 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.97 -36.39 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.286 -0.416 . . . . 54.299999999999997 110.515 175.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.14 -42.5 69.61 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.279 -0.418 . . . . 73.109999999999999 111.759 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -56.68 -49.11 76.06 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.438 0.637 . . . . 73.219999999999999 110.706 175.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -61.18 -33.47 73.49 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.492 -0.776 . . . . 71.319999999999993 111.07 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.35 -49.57 54.36 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.429 -0.35 . . . . 63.109999999999999 111.869 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.528 ' HE3' HG22 ' A' ' 22' ' ' THR . 63.6 tttm -64.35 -33.55 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.723 0.297 . . . . 71.140000000000001 111.183 -179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 84.0 m -54.54 -44.02 72.46 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.167 0.508 . . . . 73.239999999999995 110.944 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.2 pt -95.43 31.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 116.104 -0.498 . . . . 75.109999999999999 111.528 176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 9.3 p30 48.71 22.18 0.5 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.916 1.286 . . . . 64.310000000000002 114.224 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -93.61 35.98 1.1 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.122 0.487 . . . . 73.150000000000006 110.81 173.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -54.9 -29.17 55.3 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.093 -0.503 . . . . 74.219999999999999 112.022 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.44 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 80.6 p -58.63 -41.57 86.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.789 0.328 . . . . 75.549999999999997 111.075 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.6 t -59.17 -26.37 64.72 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 112.268 0.47 . . . . 72.010000000000005 112.268 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.6 mt -54.3 -37.77 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.478 0.547 . . . . 74.349999999999994 112.478 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 44.4 mt-10 -71.71 -52.88 7.75 Favored Pre-proline 0 CA--C 1.548 0.873 0 N-CA-C 112.418 0.525 . . . . 75.019999999999996 112.418 -176.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HD2' ' O ' ' A' ' 116' ' ' SER . 12.0 Cg_endo -57.57 -30.01 87.04 Favored 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 121.629 1.553 . . . . 65.329999999999998 111.961 172.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.45 -44.55 86.9 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.906 -0.405 . . . . 70.239999999999995 109.906 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.7 -36.61 76.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.26 -0.427 . . . . 61.030000000000001 111.104 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.11 -43.7 98.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.574 -0.285 . . . . 54.149999999999999 110.655 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -60.86 -44.78 96.57 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 120.764 0.316 . . . . 43.310000000000002 111.415 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.9 mm -55.57 -52.43 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.448 0.642 . . . . 72.409999999999997 111.094 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.1 m -67.78 -34.9 77.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.387 -0.824 . . . . 71.150000000000006 111.604 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.501 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 10.2 t70 -62.95 -52.45 62.98 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.471 -0.331 . . . . 73.209999999999994 110.709 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.463 HG21 ' HB2' ' A' ' 81' ' ' MET . 90.0 t -58.21 -35.03 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.43 0.633 . . . . 75.129999999999995 111.002 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 22.4 tp -65.24 -53.57 42.43 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.724 -0.671 . . . . 62.009999999999998 111.205 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -77.99 -29.01 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 N-CA-C 112.414 0.524 . . . . 64.430000000000007 112.414 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 20.7 tpp180 -49.21 -40.3 33.04 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 112.564 0.579 . . . . 62.130000000000003 112.564 -174.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.669 HG23 ' HD3' ' A' ' 133' ' ' LYS . 1.3 t -130.64 -25.62 2.34 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.847 0.684 . . . . 64.430000000000007 112.847 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.669 ' HD3' HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -95.6 17.55 14.62 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.65 -0.656 . . . . 73.409999999999997 111.968 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -45.41 -55.96 5.51 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.994 0.426 . . . . 75.140000000000001 111.894 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 5.3 m-20 -66.96 -50.62 61.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.223 -0.444 . . . . 63.520000000000003 111.163 -178.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -52.53 -36.74 56.11 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 111.967 0.358 . . . . 75.25 111.967 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 28.9 mt -57.58 -53.12 61.73 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.033 0.383 . . . . 72.099999999999994 112.033 177.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.5 p -77.16 -41.95 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 111.911 0.337 . . . . 71.450000000000003 111.911 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 75.4 mmtt -57.26 -49.88 74.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.995 0.426 . . . . 71.120000000000005 111.712 -179.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -95.17 2.42 55.02 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.016 0.376 . . . . 71.129999999999995 112.016 -177.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 57.7 mtt85 55.59 58.25 4.68 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.943 0.401 . . . . 74.530000000000001 111.382 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.3 -57.58 4.25 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 115.097 0.799 . . . . 62.329999999999998 115.097 -172.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -66.95 -26.26 66.74 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.402 0.519 . . . . 73.519999999999996 112.402 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.18 -51.22 7.68 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.871 0.367 . . . . 74.140000000000001 111.222 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.94 88.6 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 116.359 -0.382 . . . . 72.510000000000005 113.196 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -53.59 -47.38 70.19 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.109 0.481 . . . . 73.030000000000001 111.887 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.29 -46.96 95.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 116.08 -0.509 . . . . 51.130000000000003 112.007 -178.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.36 -27.15 61.33 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.08 0.4 . . . . 75.420000000000002 112.08 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -56.71 -48.99 76.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.909 0.385 . . . . 72.010000000000005 111.443 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.32 -14.83 52.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.012 0.434 . . . . 72.409999999999997 111.25 174.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 44.9 t60 68.19 85.25 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.685 0.794 . . . . 54.43 112.07 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.411 HG13 ' NH1' ' A' ' 46' ' ' ARG . 64.7 t . . . . . 0 CA--C 1.537 0.48 0 CA-C-N 115.793 -0.639 . . . . 72.140000000000001 111.247 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 . . . . . 0 CA--C 1.539 0.536 0 CA-C-O 120.863 0.363 . . . . 63.229999999999997 111.045 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -59.09 -30.61 68.21 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.036 0.446 . . . . 74.140000000000001 110.535 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.427 HD22 ' HB ' ' A' ' 138' ' ' VAL . 58.5 tp -61.91 -43.52 98.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.105 -0.498 . . . . 72.540000000000006 110.859 173.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -63.19 -48.58 77.73 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.335 -0.393 . . . . 74.310000000000002 110.669 178.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -58.71 -39.35 80.54 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.943 0.349 . . . . 72.329999999999998 111.943 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.405 ' NE2' ' HB2' ' A' ' 37' ' ' SER . 7.9 tp60 -63.73 -52.39 60.69 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 74.120000000000005 111.02 176.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 m -59.43 -46.09 89.71 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.024 -0.534 . . . . 72.109999999999999 111.197 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.0 tp -61.75 -38.98 89.99 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.949 -0.568 . . . . 73.439999999999998 111.476 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.44 -51.25 70.19 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.329 0.585 . . . . 65.239999999999995 110.892 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.5 mt -61.45 -54.32 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.542 -0.754 . . . . 72.219999999999999 111.597 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.409 HD13 HG22 ' A' ' 125' ' ' ILE . 75.1 mt -64.13 -46.28 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 116.031 -0.531 . . . . 71.129999999999995 112.097 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -56.99 -52.12 66.53 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.768 0.318 . . . . 74.430000000000007 111.727 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 15' ' ' ARG . 48.5 mtt180 -66.19 -32.61 74.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.727 0.269 . . . . 73.400000000000006 111.727 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -62.63 -54.66 36.24 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 122.101 -0.375 . . . . 75.540000000000006 110.849 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -55.66 -45.01 77.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.699 0.285 . . . . 74.109999999999999 111.343 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -62.64 -63.35 1.25 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.478 0.547 . . . . 71.310000000000002 112.478 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 65.2 mm-40 -58.25 -34.86 70.93 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 112.649 0.611 . . . . 74.200000000000003 112.649 -174.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -80.33 -27.55 38.36 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.9 -0.5 . . . . 71.349999999999994 111.913 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.5 -33.75 69.52 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.151 0.501 . . . . 61.439999999999998 110.874 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.8 p -87.31 -30.31 20.94 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.021 -0.536 . . . . 61.240000000000002 111.418 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.877 0 C-N-CA 121.302 -0.475 . . . . 61.140000000000001 112.644 -178.016 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.688 0 N-CA-C 114.052 0.381 . . . . 74.140000000000001 114.052 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.609 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -58.6 -51.4 70.05 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.879 0.325 . . . . 63.420000000000002 111.879 -177.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.9 m -57.86 -38.79 76.33 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.825 0.345 . . . . 62.409999999999997 111.604 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.405 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 23.0 t -65.12 -51.33 61.93 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.448 -0.342 . . . . 52.109999999999999 111.319 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -58.67 -45.97 88.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.576 -0.284 . . . . 72.430000000000007 111.592 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.609 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 18.1 mtpp -56.08 -48.32 76.32 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.936 0.398 . . . . 74.120000000000005 110.969 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.94 -43.65 98.41 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.36 -0.382 . . . . 63.520000000000003 111.447 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.9 tp -59.42 -53.32 59.57 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.158 0.429 . . . . 75.409999999999997 112.158 -179.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.91 -31.47 71.27 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.234 -0.291 . . . . 33.030000000000001 111.655 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.566 HG23 HG21 ' A' ' 152' ' ' VAL . 98.6 m -64.89 -43.01 94.3 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.814 0.34 . . . . 71.019999999999996 110.266 173.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.1 mt -54.12 -39.03 66.07 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.389 -0.369 . . . . 71.109999999999999 111.185 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -67.96 -45.8 73.2 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.765 0.317 . . . . 72.319999999999993 111.626 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.1 ttm-85 -61.0 -45.29 95.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.376 0.51 . . . . 71.109999999999999 112.376 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.412 ' O ' HG23 ' A' ' 51' ' ' VAL . 31.3 m -87.52 -33.74 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.073 0.463 . . . . 72.329999999999998 111.321 178.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 51' ' ' VAL . . . -69.44 -23.58 76.43 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.298 -0.477 . . . . 63.439999999999998 113.634 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.64 -53.78 34.99 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 117.183 0.492 . . . . 60.32 110.911 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.29 -44.38 28.51 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.061 -0.518 . . . . 62.039999999999999 113.017 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 47' ' ' VAL . 76.8 t -57.29 -46.06 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 112.527 0.565 . . . . 73.329999999999998 112.527 -176.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -57.31 -44.2 83.95 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 122.11 -0.369 . . . . 73.340000000000003 111.274 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -67.42 -54.11 23.21 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.47 0.545 . . . . 74.400000000000006 112.47 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -70.58 -20.06 62.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.208 0.447 . . . . 74.409999999999997 112.208 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 64.3 m-70 -90.3 -26.23 20.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.269 -0.269 . . . . 64.140000000000001 111.468 171.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.599 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 35.4 tt0 -53.08 -55.43 23.96 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.87 0.367 . . . . 70.239999999999995 111.518 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -56.4 -28.18 58.56 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.225 -0.443 . . . . 62.32 111.902 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.5 -44.63 20.86 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.904 0.383 . . . . 72.019999999999996 111.556 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.553 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.8 m-85 -70.8 -22.82 62.31 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.822 0.305 . . . . 65.349999999999994 111.822 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.448 ' NE2' ' HZ ' ' A' ' 104' ' ' PHE . 69.9 mm-40 -49.29 -35.88 19.28 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.966 0.412 . . . . 75.519999999999996 111.38 174.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.23 -30.43 70.83 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 121.267 -0.492 . . . . 60.420000000000002 112.988 177.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 72.8 mtm -89.11 -47.35 8.16 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.463 -0.433 . . . . 70.019999999999996 111.696 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.543 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 9.7 mp -56.85 -34.04 67.41 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.981 -0.449 . . . . 75.0 112.168 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -63.3 -17.42 62.52 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 120.831 0.348 . . . . 73.140000000000001 111.808 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -113.92 1.67 14.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.718 0.294 . . . . 72.420000000000002 111.145 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 63' ' ' LEU . 91.2 mt -102.94 -73.97 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.516 0.327 . . . . 64.040000000000006 111.286 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 40.95 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.79 -0.641 . . . . 72.530000000000001 112.065 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.504 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.7 mp -59.6 104.99 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.715 -0.675 . . . . 64.319999999999993 112.161 -173.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.54 -4.99 15.21 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.757 -0.656 . . . . 52.240000000000002 112.173 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.431 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -159.04 169.57 23.99 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.02 0.438 . . . . 43.030000000000001 111.798 173.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.67 -36.72 69.91 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.732 0.641 . . . . 73.409999999999997 112.732 -175.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -55.19 -35.05 64.41 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 111.689 0.255 . . . . 74.450000000000003 111.689 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.497 ' HB3' HG13 ' A' ' 68' ' ' ILE . 67.6 m-20 -62.56 -42.69 99.7 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.904 0.383 . . . . 71.230000000000004 110.81 176.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.9 t -60.81 -43.05 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.171 0.51 . . . . 74.230000000000004 110.637 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -65.78 -29.47 69.97 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.227 -0.442 . . . . 74.310000000000002 111.112 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.5 m -68.42 -37.71 80.56 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.83 0.348 . . . . 75.150000000000006 110.586 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.519 ' O ' ' HG2' ' A' ' 81' ' ' MET . 98.5 mt -58.45 -33.14 69.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.36 -0.382 . . . . 64.430000000000007 111.194 175.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -52.27 -41.4 62.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.857 0.36 . . . . 71.420000000000002 111.591 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.62 -37.47 84.08 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.396 -0.366 . . . . 72.150000000000006 111.614 178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.61 -41.65 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.976 0.417 . . . . 45.43 110.942 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.3 mmt -55.02 -42.75 72.99 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.016 -0.538 . . . . 54.43 111.487 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 82.0 mt -58.54 -40.96 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.201 -0.454 . . . . 72.510000000000005 111.237 175.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -67.98 -26.83 66.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.18 0.437 . . . . 74.409999999999997 112.18 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.526 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 62.1 t -56.7 -25.37 21.39 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.149 0.499 . . . . 61.130000000000003 110.993 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.3 m-85 . . . . . 0 CA--C 1.541 0.606 0 N-CA-C 112.808 0.67 . . . . 70.519999999999996 112.808 179.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.539 ' HE3' HG13 ' A' ' 95' ' ' ILE . 93.4 m95 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 112.147 0.425 . . . . 73.530000000000001 112.147 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.42 -24.83 56.87 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.461 -0.4 . . . . 50.539999999999999 113.296 177.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.568 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 2.8 mmp_? -67.26 -33.04 74.47 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.462 -0.434 . . . . 75.540000000000006 111.255 176.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.539 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.1 mm -63.8 -46.11 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.303 0.573 . . . . 62.210000000000001 109.669 173.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -57.59 -44.43 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.704 -0.68 . . . . 64.439999999999998 110.904 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.0 m -61.57 -44.85 96.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.324 -0.398 . . . . 72.310000000000002 111.259 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.586 ' HG ' HG23 ' A' ' 125' ' ' ILE . 41.9 tp -58.49 -54.92 41.65 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.236 0.541 . . . . 71.109999999999999 111.209 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.2 mt -65.65 -32.58 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 115.98 -0.555 . . . . 74.219999999999999 111.221 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -64.36 -48.46 75.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 116.503 -0.317 . . . . 75.329999999999998 111.449 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 105' ' ' VAL . 14.3 t80 -61.39 -43.13 99.39 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.84 0.353 . . . . 74.329999999999998 110.582 177.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.73 -44.51 95.74 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 120.932 -0.652 . . . . 73.450000000000003 112.481 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.36 94.22 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.689 0.28 . . . . 44.25 111.484 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 16.0 t80 -64.83 -45.53 85.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.805 0.336 . . . . 74.319999999999993 111.429 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.557 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.7 t -64.42 -37.94 81.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 121.973 -0.454 . . . . 74.140000000000001 110.023 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . 0.403 ' HA ' HD12 ' A' ' 109' ' ' LEU . . . -61.15 -50.69 72.16 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.338 0.496 . . . . 74.340000000000003 112.338 179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.69 -35.59 76.67 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.15 -0.344 . . . . 73.099999999999994 111.004 178.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.432 ' O ' HG12 ' A' ' 112' ' ' ILE . 86.6 t60 -68.05 -35.28 77.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.751 0.31 . . . . 70.519999999999996 110.627 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 85.7 mt -60.77 -49.47 77.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.654 -0.248 . . . . 73.120000000000005 111.057 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -62.79 -38.19 89.68 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.789 0.328 . . . . 71.430000000000007 110.93 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 99.6 m -53.6 -38.33 63.88 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.126 0.489 . . . . 73.019999999999996 111.084 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -103.59 19.5 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 116.361 -0.382 . . . . 72.409999999999997 111.921 177.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 57.03 59.17 3.57 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.324 0.583 . . . . 70.239999999999995 112.396 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -131.17 33.89 4.08 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.915 -0.584 . . . . 74.209999999999994 110.984 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.77 -33.23 66.41 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.518 0.562 . . . . 74.310000000000002 112.518 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.0 m -54.98 -27.28 42.78 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 120.791 0.329 . . . . 74.510000000000005 111.606 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.0 t -79.18 -27.18 42.61 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.022 0.379 . . . . 42.399999999999999 112.022 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.64 -45.14 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 112.807 0.669 . . . . 65.030000000000001 112.807 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.76 -53.32 44.44 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 112.712 0.634 . . . . 65.420000000000002 112.712 -176.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.34 -27.23 82.74 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 121.598 1.532 . . . . 61.509999999999998 112.216 174.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -66.08 -44.43 84.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.362 -0.607 . . . . 74.430000000000007 109.362 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.11 -37.85 81.24 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.134 -0.485 . . . . 60.509999999999998 110.842 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.85 -40.03 93.91 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.221 -0.445 . . . . 64.450000000000003 110.79 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 61.6 m -62.96 -45.42 92.51 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.787 0.327 . . . . 73.200000000000003 111.246 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.586 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.7 -52.31 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 121.5 0.667 . . . . 74.349999999999994 110.669 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.404 ' OG1' HD12 ' A' ' 13' ' ' ILE . 25.4 m -68.24 -33.46 74.43 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.225 -0.898 . . . . 61.439999999999998 111.582 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 31.1 t70 -65.05 -51.97 58.47 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.744 -0.207 . . . . 75.420000000000002 111.282 -176.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 89.3 t -59.8 -41.92 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.275 0.56 . . . . 63.399999999999999 110.549 176.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 55.0 tp -55.97 -53.34 58.13 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.51 -0.768 . . . . 60.240000000000002 111.611 176.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 68.8 t -75.25 -26.52 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 115.902 -0.59 . . . . 73.530000000000001 111.843 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 18.7 tpt180 -57.31 -37.32 72.31 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.005 0.372 . . . . 72.530000000000001 112.005 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.595 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.7 t -125.07 -38.68 2.3 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.82 0.674 . . . . 63.130000000000003 112.82 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.595 ' HG2' HG23 ' A' ' 132' ' ' THR . 33.0 mmtp -105.04 20.01 19.61 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.767 0.654 . . . . 53.340000000000003 112.767 -173.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 46.6 ttp180 -54.68 -54.27 43.96 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.232 0.539 . . . . 65.120000000000005 111.365 176.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -53.25 -44.81 68.43 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.533 -0.758 . . . . 72.409999999999997 111.659 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -62.38 -38.22 88.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 111.776 0.287 . . . . 72.109999999999999 111.776 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.9 mt -56.44 -50.07 72.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.614 0.245 . . . . 72.430000000000007 111.605 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.427 ' HB ' HD22 ' A' ' 5' ' ' LEU . 8.1 p -77.19 -43.46 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 112.101 0.408 . . . . 62.409999999999997 112.101 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -62.36 -60.34 3.69 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.962 0.411 . . . . 71.120000000000005 111.808 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -81.97 -2.99 53.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.606 -0.27 . . . . 72.299999999999997 111.648 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 70.9 mtt180 57.14 61.76 2.45 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 110.836 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -51.21 -45.1 52.29 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.703 -0.68 . . . . 74.010000000000005 114.635 -173.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -72.85 -23.81 60.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.363 0.581 . . . . 74.120000000000005 111.786 -176.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -81.74 -47.37 13.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.301 0.572 . . . . 75.120000000000005 110.215 173.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.425 ' HA2' ' CG ' ' A' ' 148' ' ' GLU . . . -62.84 -30.71 77.99 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.778 -0.646 . . . . 15.31 113.369 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -58.76 -40.56 84.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.997 0.427 . . . . 64.140000000000001 111.58 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 48.6 t -73.57 -41.75 55.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.307 -0.406 . . . . 74.109999999999999 112.056 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.425 ' CG ' ' HA2' ' A' ' 145' ' ' GLY . 0.0 OUTLIER -73.39 -31.63 64.0 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.714 0.635 . . . . 61.219999999999999 112.714 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.04 -48.72 80.57 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.036 0.446 . . . . 70.540000000000006 111.487 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -83.8 -15.08 49.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.324 -0.398 . . . . 73.049999999999997 111.387 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 76.3 t60 55.77 68.24 0.89 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.593 0.711 . . . . 64.450000000000003 111.114 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.566 HG21 HG23 ' A' ' 43' ' ' THR . 69.5 t . . . . . 0 N--CA 1.469 0.476 0 CA-C-N 115.632 -0.713 . . . . 71.319999999999993 112.631 -175.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 CA--C 1.542 0.655 0 CA-C-O 120.999 0.428 . . . . 62.439999999999998 111.959 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -63.69 -45.55 89.55 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.492 -0.322 . . . . 70.540000000000006 111.839 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.1 tp -61.02 -39.9 91.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.022 0.439 . . . . 75.409999999999997 111.146 -178.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -59.25 -47.91 83.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.202 -0.454 . . . . 75.230000000000004 110.951 174.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -44.36 94.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 111.939 0.348 . . . . 72.019999999999996 111.939 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -56.57 -52.44 64.8 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.256 0.551 . . . . 73.329999999999998 110.736 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.9 m -61.85 -43.78 98.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.775 -0.648 . . . . 75.129999999999995 111.261 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.1 -46.71 85.07 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.284 -0.416 . . . . 75.349999999999994 111.544 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -58.07 -51.17 70.79 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.935 0.398 . . . . 73.420000000000002 111.151 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.5 mt -58.62 -50.67 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.004 0.43 . . . . 74.099999999999994 111.672 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.464 HD13 HG22 ' A' ' 125' ' ' ILE . 84.7 mt -65.94 -48.77 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.217 -0.447 . . . . 63.240000000000002 111.818 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -55.34 -46.61 76.39 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.891 0.377 . . . . 71.349999999999994 110.845 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.611 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 3.3 mtt85 -53.86 -57.07 12.29 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.15 -0.477 . . . . 73.510000000000005 111.285 174.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -53.84 -45.33 70.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.394 0.516 . . . . 72.299999999999997 112.394 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.23 -45.77 87.1 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.826 0.346 . . . . 75.409999999999997 111.292 177.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.7 mmm180 -61.49 -48.34 81.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.894 0.378 . . . . 74.329999999999998 111.296 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 18.6 mm-40 -56.15 -51.63 67.29 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.129 0.49 . . . . 74.5 111.803 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.509 HE21 ' HA ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -70.92 -36.25 72.59 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.161 -0.472 . . . . 73.219999999999999 112.094 -176.595 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.5 72.83 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.043 0.386 . . . . 60.200000000000003 112.043 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.5 p -95.2 -17.06 22.06 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.338 0.496 . . . . 74.329999999999998 112.338 -178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 121.228 -0.511 . . . . 60.299999999999997 113.236 179.909 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.036 0 N-CA-C 114.265 0.466 . . . . 62.450000000000003 114.265 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.9 -49.66 72.8 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.635 0.976 . . . . 63.310000000000002 113.635 -172.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.5 m -56.33 -46.23 80.02 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.949 0.351 . . . . 75.140000000000001 111.949 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.2 p -63.67 -44.43 93.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.892 0.377 . . . . 73.239999999999995 111.302 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.8 mtp180 -63.67 -54.04 41.9 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.1 0.408 . . . . 75.420000000000002 112.1 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 0.2 OUTLIER -56.75 -37.93 71.72 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.814 0.34 . . . . 71.439999999999998 110.879 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.29 72.98 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.857 0.361 . . . . 73.129999999999995 111.445 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.414 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 44.2 tp -63.96 -44.93 91.28 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.423 -0.353 . . . . 65.420000000000002 111.828 -178.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.25 -34.49 78.12 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 122.181 -0.324 . . . . 74.299999999999997 110.677 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.575 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.7 m -61.22 -46.58 89.85 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.738 0.304 . . . . 51.130000000000003 110.385 172.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -53.99 -31.64 51.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.441 -0.345 . . . . 72.430000000000007 111.673 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.414 ' HG3' ' O ' ' A' ' 41' ' ' LEU . 65.3 mtt-85 -72.64 -54.88 7.84 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 122.031 -0.418 . . . . 74.109999999999999 111.272 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.434 ' NH1' HG13 ' A' ' 152' ' ' VAL . 15.8 ptm180 -63.69 -43.87 95.36 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.502 0.556 . . . . 75.409999999999997 112.502 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.575 HG22 ' O ' ' A' ' 43' ' ' THR . 10.7 m -87.23 -33.63 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 122.119 -0.363 . . . . 72.530000000000001 111.824 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.42 -48.33 58.22 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 120.831 -0.7 . . . . 72.420000000000002 112.808 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.0 t70 -57.27 -52.28 65.95 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.912 0.387 . . . . 71.310000000000002 110.719 176.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.21 -52.1 46.26 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 121.189 -0.529 . . . . 54.219999999999999 112.857 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.443 HG21 HG11 ' A' ' 96' ' ' VAL . 63.4 t -58.04 -43.43 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 111.726 0.269 . . . . 73.129999999999995 111.726 178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -55.73 -45.77 77.91 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.65 0.262 . . . . 60.539999999999999 111.52 177.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 53.2 mtp85 -66.81 -37.73 85.1 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.729 0.64 . . . . 74.019999999999996 112.729 -173.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.447 ' OD1' ' HD2' ' A' ' 55' ' ' HIS . 8.5 p30 -85.87 -22.15 27.67 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.592 -0.693 . . . . 73.25 112.142 177.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.447 ' HD2' ' OD1' ' A' ' 54' ' ' ASN . 12.9 m170 -86.43 -21.87 26.86 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.161 -0.337 . . . . 63.329999999999998 111.775 175.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.92 -48.46 60.69 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.414 0.524 . . . . 72.329999999999998 112.414 -176.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.7 t -56.3 -28.4 58.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.135 0.493 . . . . 75.409999999999997 112.079 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.57 -38.32 23.85 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.948 0.404 . . . . 61.310000000000002 111.718 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 18.3 m-85 -76.23 -33.16 59.21 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.624 0.601 . . . . 71.519999999999996 112.624 -176.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 63.5 mm-40 -46.29 -56.52 5.67 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.603 0.594 . . . . 72.219999999999999 112.603 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.99 -22.65 58.12 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 121.367 -0.444 . . . . 44.420000000000002 114.139 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.556 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 26.4 mtm -87.4 -36.54 17.7 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 122.032 -0.687 . . . . 72.239999999999995 109.44 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.3 tp -60.1 -33.1 71.65 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.522 -0.763 . . . . 62.409999999999997 110.953 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 54.3 mtt85 -65.47 -42.78 91.89 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.741 -0.663 . . . . 74.420000000000002 112.056 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -77.1 -15.64 59.49 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.786 0.326 . . . . 75.099999999999994 110.781 177.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 62' ' ' MET . 95.8 mt -81.95 -80.82 0.15 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.342 -0.39 . . . . 61.240000000000002 111.27 175.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.2 t70 45.24 90.44 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.34 0.656 . . . . 61.229999999999997 111.647 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.536 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.8 mp -68.55 102.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.244 0.545 . . . . 55.539999999999999 111.619 -175.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -12.03 27.81 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.128 -0.487 . . . . 70.349999999999994 111.892 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -163.0 175.16 11.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.043 0.449 . . . . 63.340000000000003 112.02 174.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -50.83 -36.99 40.31 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.881 -0.6 . . . . 70.549999999999997 112.494 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.544 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 37.7 t70 -56.87 -39.71 74.85 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 111.879 0.325 . . . . 73.239999999999995 111.879 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.529 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.0 m-20 -63.18 -36.07 82.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.883 0.373 . . . . 65.129999999999995 110.814 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.13 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.075 0.464 . . . . 65.299999999999997 110.511 175.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 9.6 mtmp? -63.96 -29.94 71.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.009 0.433 . . . . 75.310000000000002 110.821 175.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -67.57 -40.47 84.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.016 0.436 . . . . 64.319999999999993 110.618 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.1 mt -58.78 -34.73 71.77 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.402 -0.363 . . . . 71.239999999999995 111.211 176.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 47.0 m -52.16 -37.75 55.52 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.941 0.4 . . . . 65.219999999999999 110.945 176.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.499 ' HD3' HD12 ' A' ' 82' ' ' ILE . 31.0 mmt180 -64.07 -48.87 74.54 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.315 -0.402 . . . . 75.310000000000002 111.399 175.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 84' ' ' VAL . 86.8 t -55.29 -40.99 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.116 0.484 . . . . 61.140000000000001 110.489 175.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.522 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.2 mmt -60.79 -38.57 85.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.85 -0.614 . . . . 72.200000000000003 111.436 177.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.499 HD12 ' HD3' ' A' ' 79' ' ' ARG . 85.5 mt -61.32 -38.36 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-O 121.027 0.442 . . . . 72.549999999999997 110.623 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.413 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 63.0 m-70 -68.8 -28.8 67.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.383 -0.371 . . . . 74.310000000000002 111.47 175.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 80' ' ' VAL . 95.1 t -61.37 -34.48 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.919 0.39 . . . . 75.329999999999998 111.183 174.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.517 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 22.8 m-85 . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 112.012 0.375 . . . . 75.319999999999993 112.012 176.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.535 ' HE3' HG13 ' A' ' 95' ' ' ILE . 95.9 m95 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 112.761 0.652 . . . . 74.140000000000001 112.761 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.05 -25.06 53.08 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 121.228 -0.51 . . . . 60.210000000000001 112.86 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -70.57 -35.58 73.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.519 -0.401 . . . . 71.510000000000005 111.046 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.535 HG13 ' HE3' ' A' ' 92' ' ' TRP . 45.3 mm -62.73 -45.31 99.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.31 0.576 . . . . 72.409999999999997 110.037 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.443 HG11 HG21 ' A' ' 51' ' ' VAL . 43.5 t -56.02 -47.4 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 115.657 -0.702 . . . . 63.329999999999998 110.75 174.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 94.3 m -55.13 -44.14 74.79 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.537 -0.301 . . . . 54.210000000000001 111.517 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 125' ' ' ILE . 22.2 tp -58.46 -55.67 32.07 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.396 0.617 . . . . 65.310000000000002 111.648 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 55.8 mt -71.09 -32.56 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.784 -0.644 . . . . 64.530000000000001 111.317 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.4 t -61.6 -52.05 66.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.892 -0.594 . . . . 74.430000000000007 111.244 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.497 ' O ' HG23 ' A' ' 105' ' ' VAL . 23.4 t80 -63.95 -35.99 82.48 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.692 0.282 . . . . 75.209999999999994 110.87 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.08 -48.67 84.95 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 120.985 -0.626 . . . . 72.010000000000005 112.574 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.46 83.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.859 0.361 . . . . 74.510000000000005 111.348 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.471 ' CE2' HD22 ' A' ' 63' ' ' LEU . 78.3 t80 -60.72 -46.65 89.59 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.387 -0.369 . . . . 74.109999999999999 111.232 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 101' ' ' PHE . 58.0 t -64.88 -37.33 79.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 120.908 0.385 . . . . 74.120000000000005 110.512 175.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.73 -39.22 70.83 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.112 -0.495 . . . . 75.25 111.496 176.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -56.08 -49.27 74.26 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.359 0.6 . . . . 72.319999999999993 110.653 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.524 ' O ' HG12 ' A' ' 112' ' ' ILE . 58.3 t60 -63.35 -41.9 98.89 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.725 -0.671 . . . . 73.329999999999998 111.016 -179.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.536 HD21 ' HB ' ' A' ' 68' ' ' ILE . 88.5 mt -63.11 -49.96 72.4 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.062 0.458 . . . . 75.510000000000005 111.451 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -59.67 -30.26 68.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.667 -0.697 . . . . 75.530000000000001 110.63 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.5 m -77.31 -48.75 16.58 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.008 -0.542 . . . . 70.530000000000001 112.246 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 108' ' ' HIS . 42.2 pt -83.79 24.32 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 112.681 0.623 . . . . 73.329999999999998 112.681 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 62.4 18.09 10.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.549 0.574 . . . . 61.140000000000001 112.549 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -102.88 31.41 4.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.24 0.543 . . . . 62.509999999999998 110.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.26 -33.58 67.75 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.675 -0.693 . . . . 52.200000000000003 112.386 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 62.3 m -56.34 -32.75 64.98 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 120.886 0.374 . . . . 61.399999999999999 111.772 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.461 ' HB2' HD13 ' A' ' 109' ' ' LEU . 48.2 m -62.29 -26.76 68.59 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.223 0.453 . . . . 65.420000000000002 112.223 -179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.27 -44.22 74.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.849 0.685 . . . . 53.310000000000002 112.849 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -64.04 -53.76 45.66 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 112.52 0.563 . . . . 63.5 112.52 -175.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.34 -28.05 71.77 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.833 1.689 . . . . 73.349999999999994 112.276 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.2 tt -61.86 -40.68 96.22 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.99 0.424 . . . . 72.230000000000004 109.994 175.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.76 -33.83 73.53 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.239 -0.437 . . . . 75.129999999999995 111.233 175.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.344 -0.389 . . . . 63.119999999999997 110.908 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.8 m -59.01 -45.33 90.96 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.956 0.408 . . . . 33.32 111.276 175.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.549 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.5 mm -57.27 -53.17 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.213 0.53 . . . . 65.209999999999994 111.09 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 36.7 m -65.55 -38.52 89.83 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.798 -0.637 . . . . 61.049999999999997 111.91 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 29.5 t70 -59.39 -51.83 68.22 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.602 0.239 . . . . 62.119999999999997 111.226 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.522 HG21 ' HB2' ' A' ' 81' ' ' MET . 67.8 t -63.9 -39.62 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.928 0.394 . . . . 71.109999999999999 111.086 178.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.443 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -55.63 -52.47 63.7 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.324 0.583 . . . . 73.0 110.902 176.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 95.0 t -72.76 -30.44 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.806 -0.633 . . . . 71.310000000000002 111.633 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 2.0 tpt180 -57.36 -30.26 64.7 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.116 0.413 . . . . 74.109999999999999 112.116 -175.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.638 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.1 OUTLIER -130.18 -30.78 1.93 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.451 0.908 . . . . 72.230000000000004 113.451 -176.887 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.638 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.4 mptp? -112.36 23.83 13.2 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.425 -0.797 . . . . 73.329999999999998 113.007 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 16.2 ttp180 -53.85 -65.39 0.58 Allowed 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.666 0.746 . . . . 52.399999999999999 112.187 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.93 -31.6 71.94 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.154 -0.93 . . . . 61.420000000000002 111.097 -173.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -68.6 -35.82 77.87 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.404 -0.362 . . . . 62.549999999999997 111.621 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.56 ' HB2' HD21 ' A' ' 5' ' ' LEU . 52.6 mt -54.64 -45.6 73.82 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 120.555 0.217 . . . . 72.239999999999995 111.534 175.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.3 p -78.88 -43.78 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 112.329 0.492 . . . . 51.119999999999997 112.329 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -60.87 -57.76 11.29 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.128 0.489 . . . . 73.239999999999995 112.167 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -87.61 1.41 53.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.5 -0.318 . . . . 71.439999999999998 111.514 -177.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 58.15 62.2 2.1 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.306 -0.406 . . . . 72.140000000000001 110.507 -178.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 146' ' ' PHE . . . -42.85 -52.56 5.58 Favored Glycine 0 C--O 1.223 -0.545 0 CA-C-N 115.689 -0.687 . . . . 74.150000000000006 114.319 -174.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -72.04 -21.06 61.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.439 0.533 . . . . 74.0 112.439 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -84.82 -58.22 2.8 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.1 0.476 . . . . 71.340000000000003 110.66 174.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.573 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -56.84 -32.04 61.65 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 115.978 -0.555 . . . . 61.299999999999997 113.112 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 142' ' ' GLY . 80.3 t80 -54.88 -39.26 68.51 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.317 0.58 . . . . 63.350000000000001 111.14 174.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.544 HG21 ' HG3' ' A' ' 39' ' ' LYS . 96.2 t -73.51 -43.2 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 115.721 -0.672 . . . . 74.0 112.263 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.573 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 10.0 pt-20 -73.31 -33.75 65.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 111.934 0.346 . . . . 53.119999999999997 111.934 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -56.66 -48.2 78.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.1 0.476 . . . . 73.129999999999995 111.232 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.49 -5.35 59.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 72.349999999999994 111.688 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 60.74 50.44 5.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.546 0.689 . . . . 74.439999999999998 111.917 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.465 HG21 ' OG1' ' A' ' 43' ' ' THR . 97.4 t . . . . . 0 CA--C 1.54 0.574 0 CA-C-N 115.468 -0.787 . . . . 74.230000000000004 112.171 -178.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' A' ' 6' ' ' TYR . 19.4 t70 . . . . . 0 CA--C 1.545 0.776 0 CA-C-O 120.456 0.169 . . . . 70.349999999999994 111.287 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.71 -46.03 81.49 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.242 0.544 . . . . 74.409999999999997 111.496 -178.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 137' ' ' LEU . 59.8 tp -68.96 -33.5 73.8 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.218 -0.447 . . . . 62.450000000000003 110.69 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.411 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 6.6 t80 -59.88 -47.19 86.78 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.246 -0.434 . . . . 64.409999999999997 109.954 174.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -57.04 -49.64 75.21 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.965 0.358 . . . . 73.030000000000001 111.965 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 60.6 tt0 -62.53 -48.17 80.72 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.426 0.631 . . . . 63.100000000000001 111.475 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 m -59.86 -32.09 70.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.117 0.484 . . . . 54.200000000000003 110.751 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -72.75 -46.22 54.55 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.131 -0.486 . . . . 73.340000000000003 111.865 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 8' ' ' GLN . 14.1 pt-20 -57.59 -43.07 84.33 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.965 0.412 . . . . 63.240000000000002 110.765 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 67.1 mt -65.15 -54.7 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 116.053 -0.521 . . . . 61.219999999999999 111.895 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 125' ' ' ILE . 76.5 mt -66.4 -51.16 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.836 0.35 . . . . 72.129999999999995 111.857 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.511 ' HA ' ' HB1' ' A' ' 122' ' ' ALA . 47.7 t -50.04 -51.27 43.55 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.229 -0.441 . . . . 72.420000000000002 111.559 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 28.0 mtp180 -58.75 -45.99 88.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 120.853 -0.339 . . . . 74.099999999999994 111.517 176.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -53.43 -44.18 68.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.882 0.327 . . . . 64.349999999999994 111.882 -176.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -62.22 -42.65 99.5 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.815 -0.175 . . . . 63.420000000000002 111.348 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.554 ' NH2' ' HG2' ' A' ' 119' ' ' GLU . 8.4 mpt_? -61.55 -48.26 81.79 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.689 0.28 . . . . 63.109999999999999 111.34 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 16.1 mm-40 -54.45 -46.81 73.36 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.415 0.626 . . . . 65.319999999999993 111.062 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.688 ' HG3' ' HE2' ' A' ' 107' ' ' LYS . 8.6 tp-100 -75.64 -43.05 49.75 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.761 -0.654 . . . . 73.329999999999998 112.369 -175.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.27 80.38 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.251 0.463 . . . . 61.43 112.251 -177.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.8 p -87.02 -28.62 22.51 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.799 0.333 . . . . 55.399999999999999 111.644 -177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.61 0 C-N-CA 121.213 -0.517 . . . . 72.109999999999999 112.875 179.924 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.892 0 N-CA-C 113.783 0.273 . . . . 75.109999999999999 113.783 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.88 -50.13 61.6 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.862 0.69 . . . . 72.010000000000005 112.862 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.531 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 90.5 m -64.3 -40.48 96.02 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.866 0.365 . . . . 75.129999999999995 111.635 -177.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.2 m -66.06 -42.19 89.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.712 0.291 . . . . 43.530000000000001 111.453 178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -68.87 -52.77 26.14 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.627 0.251 . . . . 74.409999999999997 111.335 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HB2' HG11 ' A' ' 147' ' ' VAL . 20.6 ptmt -54.97 -39.49 69.03 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.958 0.409 . . . . 62.549999999999997 110.556 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.1 -53.2 33.05 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.261 -0.427 . . . . 74.329999999999998 111.706 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.559 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.0 tp -59.55 -40.51 87.49 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.521 0.563 . . . . 75.299999999999997 112.521 -176.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 12.3 pt-20 -73.4 -41.39 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.273 -0.267 . . . . 75.239999999999995 111.442 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.453 ' O ' HG22 ' A' ' 47' ' ' VAL . 82.7 m -69.26 -34.34 74.63 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 122.097 -0.377 . . . . 65.010000000000005 111.275 178.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -56.51 -44.05 80.37 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.883 0.327 . . . . 60.399999999999999 111.883 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.559 HH21 ' HG ' ' A' ' 41' ' ' LEU . 19.2 ptp180 -78.61 -32.38 47.47 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.996 0.427 . . . . 65.319999999999993 110.962 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.446 HH11 ' HD2' ' A' ' 46' ' ' ARG . 20.8 ttt180 -58.62 -44.88 90.11 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.061 -0.518 . . . . 75.219999999999999 111.759 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 43' ' ' THR . 32.8 m -91.66 -33.11 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.014 0.435 . . . . 74.25 111.223 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.46 -32.55 73.25 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 116.167 -0.47 . . . . 61.210000000000001 113.759 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.6 t70 -53.44 -56.65 15.08 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 117.088 0.444 . . . . 74.530000000000001 110.875 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.9 -43.79 81.63 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 121.018 -0.61 . . . . 32.310000000000002 113.066 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.433 ' HA ' HD21 ' A' ' 54' ' ' ASN . 69.7 t -57.34 -46.06 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 112.039 0.385 . . . . 74.430000000000007 112.039 -178.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -63.12 -28.07 69.82 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.878 0.325 . . . . 75.129999999999995 111.878 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 46.9 mtt180 -69.29 -52.67 25.17 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 74.409999999999997 111.422 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.433 HD21 ' HA ' ' A' ' 51' ' ' VAL . 7.7 p30 -74.47 -23.06 58.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.824 0.345 . . . . 73.299999999999997 111.791 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.422 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 17.1 m170 -82.66 -22.63 34.55 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.593 0.22 . . . . 72.340000000000003 111.593 173.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 43.1 tt0 -50.71 -56.6 11.21 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.102 0.408 . . . . 74.030000000000001 112.102 -176.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.4 t -54.89 -37.9 66.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.208 0.447 . . . . 72.200000000000003 112.208 -178.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.51 -46.04 50.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.893 0.378 . . . . 70.239999999999995 111.61 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.1 m-30 -64.63 -40.22 95.07 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.307 -0.406 . . . . 72.430000000000007 111.776 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.607 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 76.4 mm-40 -44.97 -55.07 5.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 120.779 0.323 . . . . 74.150000000000006 111.446 177.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.53 -34.76 49.99 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 116.154 -0.476 . . . . 64.329999999999998 113.961 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.8 mtm -79.46 -44.18 21.83 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.15 -0.618 . . . . 63.340000000000003 111.256 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.84 -32.81 69.75 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 111.665 0.246 . . . . 71.439999999999998 111.665 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 79.5 mtp180 -59.99 -34.87 73.91 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.364 0.602 . . . . 70.439999999999998 111.34 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -84.01 -38.88 20.36 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.95 -0.568 . . . . 62.210000000000001 111.153 177.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 77' ' ' LEU . 83.9 mt -69.56 -76.72 0.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.971 -0.559 . . . . 75.010000000000005 111.823 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 t70 43.67 85.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.312 0.577 . . . . 74.319999999999993 111.281 -172.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.7 mp -60.23 106.66 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 115.834 -0.621 . . . . 35.240000000000002 111.852 -174.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.77 -5.88 20.83 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.183 0.438 . . . . 71.420000000000002 112.183 -179.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.524 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -162.92 173.71 13.32 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.808 0.337 . . . . 64.420000000000002 111.865 174.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.28 -35.99 65.64 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.012 0.434 . . . . 53.399999999999999 111.907 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -51.55 -41.7 61.28 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.186 -0.461 . . . . 65.329999999999998 112.004 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.52 ' HB2' HG23 ' A' ' 68' ' ' ILE . 42.6 m-20 -60.47 -41.19 93.67 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.686 0.279 . . . . 73.540000000000006 111.285 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.24 -42.75 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.276 0.56 . . . . 70.209999999999994 110.936 178.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.02 -28.58 65.6 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.132 -0.485 . . . . 75.340000000000003 111.195 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -68.45 -37.31 80.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.168 0.508 . . . . 73.120000000000005 110.252 171.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 81' ' ' MET . 95.5 mt -60.43 -38.89 85.52 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.172 -0.467 . . . . 53.329999999999998 110.771 174.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.433 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.8 t -52.68 -37.92 59.67 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.121 0.486 . . . . 75.230000000000004 111.137 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -65.58 -40.33 92.6 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.141 -0.481 . . . . 75.099999999999994 110.514 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.93 -40.41 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.946 0.403 . . . . 72.030000000000001 110.896 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.5 mmt -57.17 -36.59 70.96 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.213 0.53 . . . . 72.420000000000002 110.759 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -62.08 -40.69 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 115.988 -0.551 . . . . 65.209999999999994 110.931 172.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -65.0 -32.6 74.41 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.007 0.373 . . . . 64.430000000000007 112.007 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.6 t -54.62 -41.21 54.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.027 0.441 . . . . 61.229999999999997 111.609 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 50.8 m-85 . . . . . 0 N--CA 1.471 0.61 0 N-CA-C 112.016 0.376 . . . . 75.150000000000006 112.016 178.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 19.3 m95 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.993 0.425 . . . . 73.420000000000002 111.166 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.75 -29.07 71.15 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 121.04 -0.6 . . . . 33.409999999999997 112.832 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.769 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 1.3 mmp_? -73.07 -32.38 64.98 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.495 -0.414 . . . . 71.230000000000004 111.001 176.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.7 mm -58.82 -44.73 91.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.239 0.543 . . . . 71.140000000000001 109.933 173.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 t -58.65 -43.83 88.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.814 -0.63 . . . . 70.150000000000006 110.762 174.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.4 m -54.79 -50.43 68.54 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.034 0.445 . . . . 72.299999999999997 111.218 177.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 34.9 tp -60.38 -54.83 40.89 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.833 -0.622 . . . . 72.409999999999997 112.111 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.83 -41.03 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.011 0.374 . . . . 71.409999999999997 112.011 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.1 p -59.75 -42.42 93.18 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.627 0.251 . . . . 75.340000000000003 111.336 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 21.7 t80 -63.05 -44.01 97.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.613 0.244 . . . . 53.350000000000001 110.932 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -45.93 93.4 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.051 -0.595 . . . . 70.25 112.917 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.91 78.71 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.035 0.445 . . . . 61.25 111.689 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -62.02 -43.43 98.86 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.024 0.44 . . . . 71.420000000000002 110.894 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.484 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 91.2 t -65.11 -38.33 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.405 -0.361 . . . . 62.509999999999998 110.678 176.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.99 -43.12 66.21 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.794 0.33 . . . . 64.209999999999994 111.609 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.688 ' HE2' ' HG3' ' A' ' 20' ' ' GLN . 61.9 mttm -56.61 -49.22 75.57 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.209 0.528 . . . . 71.140000000000001 111.295 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.507 ' O ' HG12 ' A' ' 112' ' ' ILE . 77.1 t60 -62.66 -35.38 79.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.145 -0.48 . . . . 73.140000000000001 110.938 179.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 117' ' ' SER . 96.1 mt -62.73 -49.52 74.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.34 -0.391 . . . . 74.230000000000004 110.977 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.482 ' HA ' ' HG3' ' A' ' 115' ' ' GLU . 85.8 tttt -57.99 -41.53 83.2 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.312 -0.403 . . . . 72.010000000000005 111.569 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 96.4 m -59.86 -41.58 91.8 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.13 -0.486 . . . . 63.299999999999997 111.849 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.507 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.5 pt -94.53 23.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.099 0.407 . . . . 74.439999999999998 112.099 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 70.37 1.36 3.57 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.096 0.776 . . . . 71.200000000000003 113.096 174.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 68' ' ' ILE . 15.1 mm100 -86.22 35.62 0.65 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 112.549 0.574 . . . . 71.349999999999994 112.549 -175.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.482 ' HG3' ' HA ' ' A' ' 110' ' ' LYS . 37.6 mt-10 -56.65 -31.76 64.7 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.671 0.272 . . . . 62.0 111.71 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 m -55.06 -32.35 61.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.002 0.43 . . . . 73.439999999999998 111.319 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . 0.499 ' HB2' HD13 ' A' ' 109' ' ' LEU . 50.1 m -70.17 -27.72 64.75 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.138 -0.483 . . . . 70.510000000000005 112.157 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.4 mt -54.51 -41.11 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.254 0.465 . . . . 64.540000000000006 112.254 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.554 ' HG2' ' NH2' ' A' ' 18' ' ' ARG . 30.8 mt-10 -65.57 -55.91 21.56 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 112.724 0.639 . . . . 73.319999999999993 112.724 -174.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.84 -28.15 51.1 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 121.78 1.653 . . . . 63.409999999999997 112.355 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.443 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.2 tt -64.29 -45.26 88.75 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 109.87 -0.419 . . . . 71.450000000000003 109.87 175.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.511 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -57.06 -37.61 72.06 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.969 0.414 . . . . 71.049999999999997 111.196 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.51 -36.52 73.81 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.179 -0.464 . . . . 73.219999999999999 111.718 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 80.0 p -62.58 -41.2 98.8 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 75.230000000000004 111.318 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.02 -52.91 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 63.399999999999999 110.975 177.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.9 m -69.55 -33.61 73.01 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.843 -0.617 . . . . 52.340000000000003 111.523 178.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.57 -52.91 63.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.684 0.278 . . . . 75.140000000000001 111.371 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.6 t -65.43 -41.16 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.11 0.481 . . . . 61.310000000000002 110.818 178.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.566 ' HG ' HD11 ' A' ' 137' ' ' LEU . 51.9 tp -54.81 -52.39 62.84 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.847 -0.615 . . . . 74.129999999999995 111.427 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.415 HG13 ' HD3' ' A' ' 134' ' ' ARG . 92.7 t -75.57 -26.94 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.142 -0.481 . . . . 75.209999999999994 111.708 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -60.53 -26.51 66.93 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.021 0.378 . . . . 73.129999999999995 112.021 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -131.44 -40.82 1.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.051 1.13 . . . . 71.409999999999997 114.051 -179.316 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.598 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.3 mptp? -103.25 20.64 17.34 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.692 0.997 . . . . 74.540000000000006 113.692 -174.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.541 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.9 ttp180 -56.05 -51.27 68.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.293 0.497 . . . . 74.310000000000002 111.607 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -57.39 -45.78 84.14 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.298 -0.41 . . . . 73.439999999999998 111.31 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -62.99 -38.33 90.74 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.411 -0.359 . . . . 64.329999999999998 111.586 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.566 HD11 ' HG ' ' A' ' 129' ' ' LEU . 65.1 mt -56.15 -49.74 73.09 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.916 0.339 . . . . 70.010000000000005 111.916 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.2 p -78.09 -42.25 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 112.166 0.432 . . . . 74.439999999999998 112.166 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -67.59 -62.47 1.4 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.169 0.433 . . . . 74.420000000000002 112.169 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.5 -8.69 59.31 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.809 0.338 . . . . 70.420000000000002 111.441 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 137' ' ' LEU . 46.2 mtt-85 60.62 83.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.551 0.691 . . . . 75.030000000000001 111.245 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -66.61 -52.92 31.03 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 115.291 -0.868 . . . . 64.219999999999999 114.125 -174.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.416 ' O ' HG23 ' A' ' 147' ' ' VAL . 50.2 m95 -68.0 -39.73 83.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.007 0.432 . . . . 73.140000000000001 111.437 -175.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -70.6 -52.8 19.03 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.788 0.327 . . . . 70.099999999999994 110.901 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -57.3 -38.87 88.88 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 116.182 -0.463 . . . . 63.340000000000003 113.446 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.57 -56.32 23.72 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.254 0.55 . . . . 73.0 111.59 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.557 HG11 ' HB2' ' A' ' 39' ' ' LYS . 90.1 t -59.93 -45.21 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.285 0.564 . . . . 72.340000000000003 112.053 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -73.68 -24.88 60.02 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.958 -0.565 . . . . 71.239999999999995 111.883 -178.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -58.05 -49.1 78.04 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.051 0.453 . . . . 71.109999999999999 110.835 172.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -82.52 -3.79 56.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.995 0.368 . . . . 75.439999999999998 111.995 178.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 24.1 t60 60.41 81.47 0.18 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.16 0.505 . . . . 72.409999999999997 111.702 179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 N--CA 1.471 0.608 0 CA-C-O 121.21 0.528 . . . . 71.430000000000007 110.545 178.807 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.785 0.326 . . . . 65.230000000000004 111.547 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -55.46 -37.27 67.54 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.394 0.616 . . . . 75.140000000000001 109.928 172.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.87 -41.47 74.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.545 -0.752 . . . . 65.25 111.554 174.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -67.41 -39.97 85.56 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.93 0.395 . . . . 71.450000000000003 110.565 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -67.18 -42.74 83.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.333 -0.394 . . . . 74.409999999999997 111.539 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.46 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.1 tt0 -61.61 -52.25 65.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.836 0.351 . . . . 64.140000000000001 111.222 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 p -58.86 -52.4 65.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.156 -0.475 . . . . 61.100000000000001 111.253 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' HG2' ' A' ' 123' ' ' GLU . 46.1 tp -54.55 -44.4 72.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.17 -0.468 . . . . 73.329999999999998 111.54 176.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.02 -51.03 71.37 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.114 0.483 . . . . 72.420000000000002 111.402 178.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 8' ' ' GLN . 75.0 mt -59.59 -52.41 61.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.182 -0.463 . . . . 75.400000000000006 111.34 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 17' ' ' LEU . 71.5 mt -62.62 -43.52 98.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 116.133 -0.485 . . . . 72.109999999999999 111.751 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 29.3 t -56.04 -54.87 39.73 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.966 0.412 . . . . 70.519999999999996 111.929 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.432 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 85.5 mtt-85 -68.3 -34.35 75.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.543 -0.299 . . . . 61.409999999999997 111.326 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.401 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 48.7 t80 -59.71 -50.92 71.95 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.904 0.383 . . . . 73.239999999999995 111.332 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.8 mp -60.64 -37.94 83.14 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 122.288 -0.258 . . . . 75.530000000000001 111.488 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 14' ' ' SER . 49.8 mmm-85 -65.71 -56.71 10.64 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 111.875 0.324 . . . . 75.209999999999994 111.875 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 10.5 pt-20 -57.17 -39.13 74.71 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.989 0.424 . . . . 70.140000000000001 112.085 -178.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 35.5 mm-40 -68.03 -37.27 81.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.827 0.346 . . . . 75.329999999999998 111.303 177.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.23 -36.07 61.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.37 0.508 . . . . 54.0 112.37 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.416 HG22 ' HE3' ' A' ' 110' ' ' LYS . 71.9 p -85.8 -37.0 19.74 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.798 0.333 . . . . 65.209999999999994 111.669 -175.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.659 0 C-N-CA 121.098 -0.572 . . . . 74.340000000000003 112.487 -177.537 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.908 0 N-CA-C 114.659 0.623 . . . . 61.409999999999997 114.659 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.23 -49.73 73.32 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.535 0.569 . . . . 53.210000000000001 112.535 -175.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.437 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 89.1 m -57.25 -46.34 83.12 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.931 0.396 . . . . 71.109999999999999 111.422 -179.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.406 ' HA ' HD11 ' A' ' 12' ' ' ILE . 22.7 p -70.47 -30.98 67.94 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.532 -0.304 . . . . 74.099999999999994 111.779 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -70.76 -56.14 7.04 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.656 0.243 . . . . 61.100000000000001 111.656 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.579 ' HG3' HG21 ' A' ' 147' ' ' VAL . 51.2 pttt -60.08 -37.26 79.37 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.739 0.304 . . . . 74.409999999999997 111.181 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.65 -46.76 89.08 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.714 0.292 . . . . 44.420000000000002 111.152 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.82 -54.1 50.24 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.993 0.425 . . . . 73.239999999999995 112.039 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 11.9 pt-20 -71.34 -26.4 62.81 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.332 0.493 . . . . 64.340000000000003 112.332 -176.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 47' ' ' VAL . 96.3 m -72.35 -36.47 68.81 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.976 -0.452 . . . . 73.019999999999996 110.734 173.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.1 mt -54.25 -49.92 68.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.049 0.389 . . . . 73.450000000000003 112.049 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 42' ' ' GLU . 5.6 ptp180 -62.35 -42.36 99.33 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.424 0.527 . . . . 72.5 112.424 -176.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -72.69 -33.07 66.26 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.364 0.505 . . . . 73.310000000000002 112.364 -174.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -93.99 -29.64 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.911 0.386 . . . . 70.140000000000001 111.721 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -77.04 -50.57 6.75 Favored Glycine 0 CA--C 1.522 0.497 0 CA-C-N 116.229 -0.442 . . . . 72.450000000000003 113.936 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -53.02 -45.78 68.13 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 117.11 0.455 . . . . 61.039999999999999 111.406 -176.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.58 -47.44 90.03 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.105 -0.569 . . . . 75.120000000000005 112.839 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.9 t -57.77 -45.05 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.86 0.362 . . . . 64.109999999999999 110.905 176.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 26.8 mt-30 -56.32 -41.62 76.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.214 -0.448 . . . . 74.019999999999996 111.156 176.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -67.42 -47.7 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.382 0.512 . . . . 61.020000000000003 112.382 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -70.82 -32.83 70.02 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.283 0.563 . . . . 71.319999999999993 111.425 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -81.42 -18.37 45.64 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.247 -0.433 . . . . 74.25 112.077 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 35.1 tt0 -48.84 -43.56 38.71 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.578 0.585 . . . . 72.109999999999999 112.578 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.0 t -55.2 -34.67 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.928 0.394 . . . . 74.430000000000007 111.608 178.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.77 -41.37 21.27 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.368 -0.378 . . . . 63.210000000000001 111.799 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -64.7 -40.87 96.12 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.96 0.356 . . . . 63.149999999999999 111.96 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 79.8 mm-40 -54.37 -36.31 63.75 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.8 0.333 . . . . 71.230000000000004 111.344 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.57 -31.7 63.87 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 116.188 -0.46 . . . . 74.530000000000001 112.834 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 59.1 mtm -89.27 -43.82 10.69 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.72 0.295 . . . . 54.119999999999997 111.019 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mp -53.07 -34.24 55.66 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.236 0.458 . . . . 73.439999999999998 112.236 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -66.09 -28.99 69.24 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.105 0.409 . . . . 73.329999999999998 112.105 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -9.24 23.15 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.121 0.486 . . . . 73.329999999999998 111.273 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -89.58 -74.87 0.46 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.31 -0.405 . . . . 75.310000000000002 111.155 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 t70 34.29 91.03 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.951 0.9 . . . . 72.349999999999994 112.249 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.49 ' N ' HD12 ' A' ' 68' ' ' ILE . 1.7 mp -64.3 104.21 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.87 -0.605 . . . . 64.430000000000007 111.888 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.73 -6.15 27.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.138 -0.483 . . . . 71.239999999999995 111.697 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.439 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.13 164.72 30.43 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.766 0.317 . . . . 64.040000000000006 111.324 173.67 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.95 -30.66 64.25 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.381 0.512 . . . . 62.229999999999997 112.381 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.65 -36.7 64.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.095 0.405 . . . . 74.409999999999997 112.095 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 54.7 m-20 -62.69 -43.15 99.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.03 0.443 . . . . 71.400000000000006 110.409 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.3 t -58.25 -48.22 85.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 116.029 -0.532 . . . . 54.329999999999998 111.014 177.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -59.83 -33.22 71.48 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.068 0.461 . . . . 74.340000000000003 111.095 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.1 t -70.12 -34.25 72.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.387 -0.37 . . . . 61.149999999999999 111.375 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.423 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.8 mt -58.35 -32.74 68.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.679 0.276 . . . . 72.219999999999999 111.111 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.2 t -52.76 -35.48 56.45 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.014 0.435 . . . . 65.120000000000005 111.167 176.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -63.63 -46.46 85.61 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.992 0.425 . . . . 74.439999999999998 110.57 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 84' ' ' VAL . 60.1 t -58.22 -43.07 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.396 -0.366 . . . . 75.209999999999994 110.629 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.3 mmt -56.58 -38.79 72.48 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.855 -0.611 . . . . 72.519999999999996 111.84 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 78' ' ' SER . 55.2 mt -65.1 -36.49 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.169 0.509 . . . . 51.109999999999999 110.95 175.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.85 -27.76 60.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.246 -0.434 . . . . 72.340000000000003 112.103 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 80' ' ' VAL . 70.8 t -52.2 -34.85 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 CA-C-O 120.859 0.362 . . . . 71.530000000000001 111.304 177.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.481 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.6 m-85 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 112.408 0.521 . . . . 74.340000000000003 112.408 178.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.0 m95 . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 112.608 0.596 . . . . 71.109999999999999 112.608 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.55 52.98 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 121.185 -0.531 . . . . 70.140000000000001 113.309 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -70.24 -30.63 67.74 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.97 0.414 . . . . 54.310000000000002 111.264 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.36 -39.23 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 121.275 0.56 . . . . 61.350000000000001 109.622 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.02 -47.7 89.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.593 -0.731 . . . . 72.040000000000006 110.775 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.1 m -53.4 -45.81 69.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 111.873 0.323 . . . . 74.219999999999999 111.873 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.481 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 40.3 tp -61.23 -55.1 35.91 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.162 0.505 . . . . 71.030000000000001 111.909 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.0 mt -68.73 -38.82 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.262 -0.426 . . . . 52.409999999999997 111.75 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.9 p -65.1 -45.41 85.32 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.285 -0.416 . . . . 72.340000000000003 111.048 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 25.1 t80 -56.74 -40.57 75.99 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.762 0.315 . . . . 62.340000000000003 110.781 174.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -48.34 84.71 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.037 -0.601 . . . . 62.329999999999998 112.457 174.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.74 -32.35 73.85 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.886 0.374 . . . . 71.200000000000003 111.584 177.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -64.73 -46.85 80.51 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.974 0.416 . . . . 74.420000000000002 110.688 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.465 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 61.1 t -65.74 -36.77 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 116.347 -0.388 . . . . 63.329999999999998 110.227 175.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.91 -46.94 78.28 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.126 -0.488 . . . . 61.439999999999998 111.847 177.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -54.78 -47.6 73.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.416 0.627 . . . . 64.120000000000005 110.601 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.488 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.9 t60 -63.17 -36.71 84.52 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.714 -0.675 . . . . 74.120000000000005 111.31 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 73.9 mt -63.61 -51.07 66.87 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 111.634 0.235 . . . . 74.120000000000005 111.634 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HE3' HG22 ' A' ' 22' ' ' THR . 65.9 tttm -61.25 -38.61 87.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.151 0.501 . . . . 64.439999999999998 110.507 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 93.7 m -57.84 -45.94 85.5 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.853 -0.612 . . . . 65.439999999999998 111.397 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.4 pt -88.22 22.09 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 120.752 0.31 . . . . 74.340000000000003 111.789 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.634 HD22 ' N ' ' A' ' 113' ' ' ASN . 0.7 OUTLIER 69.34 14.14 8.49 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.885 0.698 . . . . 64.430000000000007 112.885 173.106 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -100.78 37.24 1.76 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.167 0.432 . . . . 75.439999999999998 112.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.517 ' HG3' HD12 ' A' ' 118' ' ' ILE . 43.3 tt0 -60.2 -34.27 73.4 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.928 -0.482 . . . . 74.540000000000006 111.86 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.2 m -57.02 -28.93 62.92 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 122.177 -0.327 . . . . 65.319999999999993 111.843 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.7 m -73.48 -26.81 61.07 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.078 0.399 . . . . 63.439999999999998 112.078 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.517 HD12 ' HG3' ' A' ' 115' ' ' GLU . 66.2 mt -55.2 -45.92 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.772 0.656 . . . . 44.25 112.772 -177.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.81 -52.38 42.3 Favored Pre-proline 0 CA--C 1.549 0.925 0 N-CA-C 112.693 0.627 . . . . 54.520000000000003 112.693 -174.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -59.04 -27.87 86.24 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.568 1.512 . . . . 72.430000000000007 112.354 173.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.416 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.8 tt -64.73 -44.95 88.49 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.837 -0.431 . . . . 72.25 109.837 173.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.512 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.26 -40.54 82.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.057 0.456 . . . . 70.099999999999994 111.099 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 10' ' ' LEU . 32.3 mt-10 -63.09 -36.63 84.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.088 -0.506 . . . . 74.219999999999999 111.119 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.2 m -65.27 -44.24 88.69 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.595 -0.275 . . . . 71.530000000000001 111.287 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' LEU . 48.7 mm -53.98 -53.13 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.131 0.491 . . . . 63.130000000000003 110.61 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -62.93 -39.84 95.81 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.669 -0.696 . . . . 74.209999999999994 111.625 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -54.35 -51.61 64.22 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.419 -0.355 . . . . 64.140000000000001 111.173 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 132' ' ' THR . 58.8 t -68.36 -46.27 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.296 -0.411 . . . . 60.109999999999999 111.13 177.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -51.56 -52.8 44.27 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.848 -0.615 . . . . 72.340000000000003 111.89 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 66.0 t -76.06 -32.19 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 116.194 -0.457 . . . . 45.329999999999998 111.861 -178.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -56.19 -39.38 72.34 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.042 0.386 . . . . 73.310000000000002 112.042 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.448 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.5 t -104.57 -42.64 5.37 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.886 0.699 . . . . 63.299999999999997 112.886 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.404 ' HD3' HG23 ' A' ' 132' ' ' THR . 12.4 mptt -102.47 26.12 8.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.681 0.623 . . . . 54.409999999999997 112.681 -176.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 1.1 tpm_? -45.28 -53.08 8.86 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.088 0.555 . . . . 74.310000000000002 112.256 175.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 3.9 m-20 -69.6 -52.19 28.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 73.340000000000003 111.779 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -58.85 -37.94 77.61 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.06 0.392 . . . . 73.439999999999998 112.06 -176.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 34.1 mt -54.79 -51.51 65.55 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.037 0.384 . . . . 75.400000000000006 112.037 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . 0.446 ' HB ' HH21 ' A' ' 134' ' ' ARG . 14.8 p -79.0 -36.56 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 112.441 0.534 . . . . 72.519999999999996 112.441 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 73.9 mmtt -65.52 -45.71 82.44 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.286 0.476 . . . . 64.430000000000007 112.286 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -102.32 7.05 40.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.619 0.247 . . . . 74.530000000000001 111.561 -176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 52.81 71.79 0.46 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.27 -0.423 . . . . 64.439999999999998 110.802 -176.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -49.62 -44.91 38.42 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 114.638 0.615 . . . . 74.120000000000005 114.638 -172.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -75.29 -20.02 59.35 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.447 0.536 . . . . 63.409999999999997 112.447 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -84.28 -51.06 7.29 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.897 0.379 . . . . 75.450000000000003 110.327 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -54.3 -40.31 67.69 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.961 -0.563 . . . . 23.140000000000001 113.153 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.35 -53.46 57.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 122.704 0.402 . . . . 60.439999999999998 111.894 175.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.579 HG21 ' HG3' ' A' ' 39' ' ' LYS . 80.0 t -64.22 -42.73 96.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.002 0.43 . . . . 53.25 111.988 -177.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.91 -27.81 61.23 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.911 0.337 . . . . 60.439999999999998 111.911 179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -56.15 -46.35 79.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.194 0.521 . . . . 73.230000000000004 111.464 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -82.48 4.0 26.07 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.132 -0.485 . . . . 62.450000000000003 111.553 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.8 m170 56.52 54.44 7.47 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.806 0.669 . . . . 74.209999999999994 112.806 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 56.0 t . . . . . 0 CA--C 1.538 0.51 0 CA-C-O 121.255 0.55 . . . . 71.349999999999994 109.873 169.269 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 t70 . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 120.485 0.183 . . . . 72.150000000000006 111.446 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.18 -47.83 80.24 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.254 0.549 . . . . 71.519999999999996 111.472 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -68.05 -36.54 80.05 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.804 -0.635 . . . . 64.299999999999997 110.704 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.39 -51.55 65.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.842 -0.617 . . . . 71.530000000000001 110.523 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 7' ' ' ARG . 7.4 tpt180 -65.47 -40.78 93.58 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.726 0.269 . . . . 64.310000000000002 111.726 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -57.62 -52.94 63.37 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.996 0.427 . . . . 72.319999999999993 110.968 174.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.06 -40.57 94.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.001 -0.545 . . . . 71.219999999999999 110.755 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 123' ' ' GLU . 42.1 tp -59.48 -44.83 92.96 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.958 -0.565 . . . . 43.509999999999998 111.518 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 42.7 tt0 -64.91 -50.34 66.89 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.748 0.309 . . . . 71.219999999999999 110.982 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.5 -48.03 80.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.884 0.373 . . . . 74.019999999999996 111.374 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.469 ' O ' HD13 ' A' ' 17' ' ' LEU . 81.0 mt -64.8 -44.67 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 116.492 -0.322 . . . . 64.400000000000006 111.43 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 38.5 t -53.96 -50.96 65.33 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.954 0.407 . . . . 74.150000000000006 111.109 177.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 61.7 mtt-85 -61.26 -49.19 78.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.225 -0.443 . . . . 74.340000000000003 111.105 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.404 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 20.1 t80 -53.95 -50.85 65.57 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.069 0.396 . . . . 64.230000000000004 112.069 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -55.77 -46.82 77.83 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.947 0.404 . . . . 74.219999999999999 111.352 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 14' ' ' SER . 35.2 mtp180 -66.02 -53.57 36.86 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 73.329999999999998 112.07 -179.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.531 ' CD ' HH21 ' A' ' 45' ' ' ARG . 15.1 pt-20 -62.59 -31.04 71.79 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 111.883 0.327 . . . . 72.340000000000003 111.883 -179.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.626 ' HG2' HE22 ' A' ' 52' ' ' GLN . 0.1 OUTLIER -75.57 -27.92 58.77 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.936 0.398 . . . . 71.030000000000001 111.241 179.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.69 -40.7 17.06 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.945 0.402 . . . . 74.340000000000003 111.708 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.408 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 44.2 p -87.39 -37.19 17.28 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.003 0.43 . . . . 73.310000000000002 111.955 -177.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 C-N-CA 121.263 -0.494 . . . . 32.409999999999997 112.767 -176.171 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.898 0 N-CA-C 112.443 -0.263 . . . . 73.5 112.443 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -50.63 69.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.136 0.421 . . . . 71.450000000000003 112.136 -176.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.06 -33.62 72.31 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.008 0.432 . . . . 73.519999999999996 111.176 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.9 t -68.89 -40.99 78.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.38 -0.373 . . . . 64.129999999999995 111.15 178.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -62.61 -50.32 71.72 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.42 0.629 . . . . 63.0 110.539 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -57.78 -45.4 86.04 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.165 -0.925 . . . . 71.409999999999997 111.829 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.439 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -59.4 -49.94 75.89 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.932 0.396 . . . . 62.43 111.383 177.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.9 tp -60.52 -52.6 64.52 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.268 -0.424 . . . . 71.200000000000003 111.862 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -61.02 -32.95 72.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.784 0.326 . . . . 50.109999999999999 111.589 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.499 ' O ' HG22 ' A' ' 47' ' ' VAL . 83.4 m -73.57 -41.4 62.97 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.269 -0.27 . . . . 60.340000000000003 110.836 177.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.8 mt -54.34 -45.64 72.73 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.142 0.423 . . . . 62.149999999999999 112.142 178.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.531 HH21 ' CD ' ' A' ' 19' ' ' GLU . 12.5 ptp180 -65.02 -42.26 94.56 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.169 -0.332 . . . . 74.109999999999999 111.705 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 46' ' ' ARG . 13.8 ttm180 -68.43 -45.29 72.98 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.921 0.341 . . . . 64.219999999999999 111.921 -176.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 21.0 m -86.32 -31.01 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.908 0.385 . . . . 70.5 111.709 -179.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.98 94.1 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.321 -0.466 . . . . 70.299999999999997 112.944 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.499 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 17.9 t70 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.881 0.372 . . . . 72.430000000000007 110.823 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.4 -46.42 80.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 121.307 -0.473 . . . . 52.520000000000003 112.966 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.66 -42.32 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 120.871 0.367 . . . . 63.210000000000001 111.168 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.626 HE22 ' HG2' ' A' ' 20' ' ' GLN . 79.0 mt-30 -63.25 -43.01 99.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.27 -0.423 . . . . 71.219999999999999 111.924 179.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 45.3 mtm-85 -58.2 -45.35 87.77 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.014 0.435 . . . . 70.010000000000005 111.611 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -73.87 -45.33 51.62 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.212 0.529 . . . . 72.349999999999994 111.656 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -77.27 -16.16 59.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.228 0.825 . . . . 63.439999999999998 113.228 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -46.87 -52.18 14.99 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.029 0.752 . . . . 74.230000000000004 113.029 -172.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 t -60.29 -30.62 69.58 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.022 0.379 . . . . 54.340000000000003 112.022 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.74 -50.94 11.37 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.983 0.421 . . . . 74.120000000000005 111.45 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -60.46 -42.26 95.8 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.167 0.432 . . . . 72.5 112.167 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -51.43 -39.88 58.25 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 111.955 0.354 . . . . 74.450000000000003 111.955 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.94 -34.74 72.96 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 121.289 -0.481 . . . . 64.019999999999996 113.253 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.485 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 49.1 mtm -89.77 -35.23 15.84 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.335 0.588 . . . . 63.210000000000001 110.314 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.555 HD21 ' HB2' ' A' ' 108' ' ' HIS . 14.7 tp -56.99 -42.41 80.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.616 -0.72 . . . . 64.019999999999996 111.793 -175.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.15 -15.47 63.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.961 0.726 . . . . 73.140000000000001 112.961 -177.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 0.74 19.32 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.24 0.543 . . . . 73.129999999999995 111.225 174.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 62' ' ' MET . 94.8 mt -96.23 -69.7 0.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.036 -0.529 . . . . 73.219999999999999 110.705 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 69.63 -52.08 0.62 Allowed 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 113.649 0.981 . . . . 62.340000000000003 113.649 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.436 HD11 HD21 ' A' ' 77' ' ' LEU . 2.4 mp 64.94 99.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.483 0.713 . . . . 65.310000000000002 111.478 -174.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.09 -14.89 13.82 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.306 -0.406 . . . . 72.439999999999998 112.019 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -150.56 173.45 14.09 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.625 0.25 . . . . 63.109999999999999 110.946 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.77 -35.48 68.71 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.557 0.577 . . . . 74.209999999999994 112.557 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -54.29 -42.26 69.86 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 122.311 -0.243 . . . . 62.520000000000003 111.472 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 44.3 m-20 -63.29 -43.54 97.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.094 0.473 . . . . 52.340000000000003 110.559 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.3 t -57.99 -46.7 87.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.932 -0.576 . . . . 75.400000000000006 111.189 176.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -69.61 -28.57 66.05 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.895 0.379 . . . . 70.150000000000006 111.481 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.7 m -68.33 -32.04 71.87 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.912 0.387 . . . . 64.340000000000003 110.778 174.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.475 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.6 mt -59.73 -34.26 72.71 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.732 0.301 . . . . 71.099999999999994 110.852 174.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.1 t -52.64 -35.73 55.33 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.27 -0.423 . . . . 63.130000000000003 111.576 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -58.25 -42.3 86.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.975 0.417 . . . . 74.430000000000007 110.969 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 65.9 t -73.46 -39.25 54.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.136 0.494 . . . . 73.409999999999997 110.845 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 98' ' ' LEU . 18.2 mmt -56.74 -39.92 74.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.04 -0.527 . . . . 74.230000000000004 111.532 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -60.0 -35.49 61.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.818 0.342 . . . . 43.109999999999999 111.389 175.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.6 m-70 -65.33 -39.45 92.44 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.895 0.378 . . . . 65.519999999999996 111.328 176.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.7 t -58.59 -32.83 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 120.893 0.378 . . . . 71.310000000000002 111.404 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.488 ' CE2' HD22 ' A' ' 98' ' ' LEU . 17.0 m-30 . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 112.504 0.557 . . . . 63.039999999999999 112.504 178.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.45 ' HE3' HG13 ' A' ' 95' ' ' ILE . 33.1 m95 . . . . . 0 CA--C 1.538 0.489 0 CA-C-O 120.653 0.263 . . . . 73.450000000000003 111.457 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.97 -37.82 45.64 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.589 -0.338 . . . . 64.450000000000003 113.341 177.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 94' ' ' ARG . 22.2 mmt180 -66.31 -40.74 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 122.491 -0.417 . . . . 73.430000000000007 111.43 176.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.45 HG13 ' HE3' ' A' ' 92' ' ' TRP . 37.2 mm -61.53 -44.47 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.274 0.559 . . . . 73.510000000000005 110.062 175.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 92' ' ' TRP . 51.6 t -60.89 -41.15 87.72 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.831 -0.622 . . . . 70.239999999999995 110.963 175.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.1 m -55.44 -48.13 74.94 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.747 0.308 . . . . 53.439999999999998 111.277 178.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.557 HD11 ' SD ' ' A' ' 81' ' ' MET . 19.4 tp -62.56 -54.44 39.81 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.148 0.499 . . . . 71.120000000000005 111.501 -179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.9 mt -64.85 -38.31 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.048 -0.523 . . . . 74.040000000000006 111.497 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -63.21 -45.5 91.41 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.223 -0.444 . . . . 64.409999999999997 111.168 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 105' ' ' VAL . 26.5 t80 -61.05 -39.17 88.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.735 0.302 . . . . 74.340000000000003 110.568 175.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.13 -47.35 88.25 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 121.022 -0.609 . . . . 51.039999999999999 112.474 174.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.32 -35.57 81.4 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.203 0.525 . . . . 62.5 111.471 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.07 -46.73 87.8 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.023 -0.535 . . . . 70.219999999999999 110.848 177.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 101' ' ' PHE . 46.4 t -65.56 -36.43 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 116.353 -0.385 . . . . 73.109999999999999 110.613 175.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.06 -39.43 69.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.338 -0.392 . . . . 64.430000000000007 111.721 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -58.42 -44.47 89.09 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.226 0.536 . . . . 75.219999999999999 110.932 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.555 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.1 t60 -65.66 -42.62 91.16 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.128 -0.487 . . . . 74.530000000000001 110.701 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.431 HD21 ' HB ' ' A' ' 68' ' ' ILE . 97.5 mt -59.66 -50.36 74.18 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.287 -0.415 . . . . 63.140000000000001 111.086 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HE2' ' HA ' ' A' ' 22' ' ' THR . 64.7 tttp -56.26 -43.8 79.07 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.282 -0.417 . . . . 74.209999999999994 111.412 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.0 m -60.69 -44.04 97.02 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.166 -0.47 . . . . 64.129999999999995 112.011 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 108' ' ' HIS . 34.3 pt -89.68 16.46 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 N-CA-C 112.308 0.484 . . . . 65.120000000000005 112.308 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . 0.603 HD22 ' N ' ' A' ' 113' ' ' ASN . 0.7 OUTLIER 75.98 7.29 3.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.007 0.743 . . . . 61.539999999999999 113.007 175.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -82.72 33.69 0.43 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.551 0.34 . . . . 71.109999999999999 111.645 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.4 ' CD ' HH21 ' A' ' 18' ' ' ARG . 2.4 tm-20 -57.03 -30.76 64.49 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.043 0.449 . . . . 71.209999999999994 111.433 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.431 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 58.7 m -69.62 -39.66 77.06 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.18 -0.325 . . . . 53.200000000000003 111.636 176.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.6 m -54.69 -26.31 32.78 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.074 0.398 . . . . 64.349999999999994 112.074 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.0 mt -53.89 -39.18 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 112.097 0.406 . . . . 70.450000000000003 112.097 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.23 -54.99 16.74 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 112.518 0.562 . . . . 70.040000000000006 112.518 -175.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.431 ' HD2' ' O ' ' A' ' 116' ' ' SER . 20.9 Cg_endo -61.35 -26.85 82.15 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.769 1.646 . . . . 61.450000000000003 112.394 174.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.68 -47.44 75.44 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.776 -0.453 . . . . 74.409999999999997 109.776 174.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.5 -36.81 69.59 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.052 -0.522 . . . . 71.5 111.143 174.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HA ' HD13 ' A' ' 10' ' ' LEU . 44.7 mt-10 -63.85 -44.94 91.64 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.353 -0.385 . . . . 73.439999999999998 111.159 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -60.77 -45.25 95.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.786 0.326 . . . . 64.230000000000004 111.456 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.3 mm -53.76 -52.22 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.213 0.53 . . . . 43.200000000000003 110.734 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -66.32 -33.39 75.62 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.928 -0.578 . . . . 64.439999999999998 111.818 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.27 -51.63 65.34 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.833 0.349 . . . . 73.140000000000001 110.684 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 81' ' ' MET . 60.4 t -64.19 -36.73 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.017 0.437 . . . . 73.230000000000004 111.222 176.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.9 tp -57.51 -52.89 63.57 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.158 -0.474 . . . . 73.310000000000002 111.5 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 59.8 t -76.55 -24.66 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 116.426 -0.352 . . . . 72.409999999999997 111.658 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -44.74 -52.57 8.23 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.147 0.579 . . . . 74.420000000000002 112.513 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.04 -25.26 2.53 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.177 0.806 . . . . 72.109999999999999 113.177 -174.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 129' ' ' LEU . 1.1 mpmm? -85.27 11.39 10.17 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.647 -0.658 . . . . 73.049999999999997 111.847 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.404 ' HD3' HH11 ' A' ' 134' ' ' ARG . 9.0 tpt180 -47.39 -60.65 2.37 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 112.645 0.609 . . . . 64.519999999999996 112.645 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.93 -37.81 88.88 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 64.019999999999996 111.752 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -62.58 -38.98 92.21 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.751 0.31 . . . . 71.109999999999999 111.484 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.57 HD11 ' HG ' ' A' ' 129' ' ' LEU . 72.2 mt -59.79 -49.58 77.17 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.803 0.335 . . . . 44.210000000000001 111.67 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.9 p -75.44 -40.13 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.037 0.384 . . . . 61.130000000000003 112.037 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 36.4 mmtm -68.29 -44.09 76.25 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.386 0.513 . . . . 64.310000000000002 112.386 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -88.66 5.69 41.91 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.861 0.362 . . . . 71.109999999999999 110.99 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 59.57 29.28 18.83 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.084 0.554 . . . . 75.420000000000002 112.164 177.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.43 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 18.24 -86.93 0.0 OUTLIER Glycine 0 C--N 1.339 0.743 0 N-CA-C 115.917 1.127 . . . . 63.32 115.917 175.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.557 ' O ' HG23 ' A' ' 147' ' ' VAL . 14.1 m95 -75.09 -34.46 61.75 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.823 0.675 . . . . 70.209999999999994 112.823 -171.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -63.84 -52.49 59.88 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.04 0.448 . . . . 62.149999999999999 110.305 174.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.51 -35.6 92.14 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-N 115.863 -0.608 . . . . 50.130000000000003 112.718 178.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.17 -48.72 73.36 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.041 0.536 . . . . 64.420000000000002 111.998 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.4 t -65.1 -45.23 94.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.317 0.488 . . . . 62.32 112.317 -176.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -73.92 -27.46 61.04 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 122.143 -0.348 . . . . 64.439999999999998 111.872 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -57.09 -50.29 73.23 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.012 0.434 . . . . 71.25 111.326 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.37 -8.93 59.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.171 -0.468 . . . . 71.439999999999998 111.22 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 7.6 t60 65.27 71.91 0.43 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.475 0.71 . . . . 63.420000000000002 112.147 176.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 67.1 t . . . . . 0 N--CA 1.471 0.582 0 CA-C-N 116.109 -0.496 . . . . 64.140000000000001 110.757 175.696 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 112.179 0.437 . . . . 74.530000000000001 112.179 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -52.02 -45.51 64.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 111.414 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.39 -41.81 73.17 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.006 0.373 . . . . 70.049999999999997 112.006 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -66.96 -51.92 49.2 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.869 0.366 . . . . 74.150000000000006 110.694 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -59.56 -37.12 77.62 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.226 -0.443 . . . . 72.349999999999994 111.284 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -65.4 -52.1 55.75 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.992 -0.549 . . . . 74.299999999999997 111.482 177.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.1 m -57.32 -48.48 78.86 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.283 -0.417 . . . . 73.120000000000005 110.912 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.11 -39.84 87.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.315 -0.402 . . . . 73.140000000000001 111.3 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.0 -52.1 66.91 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 72.439999999999998 111.526 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 60.1 mt -63.65 -53.14 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 115.964 -0.562 . . . . 72.409999999999997 111.51 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.1 mt -63.0 -49.33 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.979 -0.555 . . . . 74.129999999999995 112.144 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 t -54.6 -50.82 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.85 0.357 . . . . 62.140000000000001 111.091 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 52.2 mtt180 -55.09 -54.71 39.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.381 -0.372 . . . . 74.099999999999994 110.602 175.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -52.88 -44.93 67.25 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.547 0.573 . . . . 71.430000000000007 112.547 -175.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.3 mp -58.67 -51.43 69.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.643 0.259 . . . . 74.519999999999996 111.529 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -69.47 -26.31 64.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 120.75 -0.38 . . . . 72.299999999999997 111.894 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 6.3 mm-40 -64.34 -41.84 96.56 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.099 0.476 . . . . 74.329999999999998 110.652 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 25.7 mm-40 -72.26 -37.78 69.0 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.982 -0.554 . . . . 65.25 111.995 178.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.7 -43.65 88.51 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.92 0.391 . . . . 54.439999999999998 111.836 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.4 p -87.81 -37.81 16.25 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.847 0.356 . . . . 74.430000000000007 111.845 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 121.473 -0.394 . . . . 31.140000000000001 113.133 179.87 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 38' ' ' ARG . . . . . . . . 0 CA--C 1.526 0.746 0 N-CA-C 112.175 -0.37 . . . . 55.539999999999999 112.175 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.5 -50.01 66.89 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.215 0.45 . . . . 72.010000000000005 112.215 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.458 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 86.8 m -57.08 -42.25 80.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.066 0.46 . . . . 55.520000000000003 111.394 -178.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.7 t -64.26 -43.87 93.51 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.354 -0.385 . . . . 74.019999999999996 111.77 178.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 34' ' ' GLY . 44.3 mtp-105 -65.24 -53.45 44.29 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.771 0.286 . . . . 73.230000000000004 111.771 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HG3' HG21 ' A' ' 147' ' ' VAL . 19.6 ptmt -56.11 -37.51 69.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.103 0.478 . . . . 74.019999999999996 111.049 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.53 -47.3 70.3 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.415 -0.357 . . . . 73.510000000000005 111.213 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.2 tp -62.76 -38.54 90.97 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.23 0.456 . . . . 70.329999999999998 112.23 -177.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.11 -34.37 61.69 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.671 0.272 . . . . 54.210000000000001 111.508 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.533 HG23 HG21 ' A' ' 152' ' ' VAL . 88.3 m -75.9 -40.22 54.82 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 111.923 0.342 . . . . 53.109999999999999 111.923 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.4 mt -53.53 -35.28 60.54 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.61 0.596 . . . . 54.229999999999997 112.61 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.444 HH21 ' HG ' ' A' ' 41' ' ' LEU . 12.7 ptp180 -77.86 -42.01 34.93 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.04 -0.412 . . . . 54.310000000000002 112.097 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.407 ' NH1' HG13 ' A' ' 152' ' ' VAL . 17.0 ptm180 -68.71 -32.53 72.39 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.05 0.389 . . . . 70.219999999999999 112.05 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 22.3 m -94.14 -34.77 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 O-C-N 121.978 -0.451 . . . . 74.409999999999997 111.777 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.34 -48.8 49.73 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.439 -0.41 . . . . 72.420000000000002 113.605 -174.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 34.6 t70 -63.31 -36.11 82.59 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 122.438 -0.448 . . . . 70.030000000000001 110.778 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -49.96 70.71 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 121.147 -0.549 . . . . 64.439999999999998 112.488 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.511 ' HA ' HD21 ' A' ' 54' ' ' ASN . 81.7 t -57.91 -43.26 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.963 0.411 . . . . 61.439999999999998 111.161 175.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.406 ' O ' ' N ' ' A' ' 56' ' ' GLU . 43.0 mt-30 -54.51 -45.8 73.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 112.074 176.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 24.3 mmm180 -65.29 -50.01 67.35 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.077 0.769 . . . . 61.450000000000003 113.077 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.511 HD21 ' HA ' ' A' ' 51' ' ' VAL . 10.0 p30 -69.72 -30.57 68.22 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.741 -0.599 . . . . 61.409999999999997 110.911 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -82.13 -18.51 42.64 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.287 -0.415 . . . . 72.530000000000001 112.008 174.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 52' ' ' GLN . 37.1 tt0 -49.84 -48.15 51.21 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.325 0.491 . . . . 74.049999999999997 112.325 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -52.44 -33.73 45.45 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.949 0.404 . . . . 63.240000000000002 111.735 176.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.55 -54.29 5.8 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.295 -0.411 . . . . 62.140000000000001 111.585 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -56.59 -35.9 68.77 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.353 0.501 . . . . 75.439999999999998 112.353 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -56.44 -39.69 73.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.953 0.406 . . . . 44.109999999999999 110.91 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.445 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -61.52 -23.24 62.47 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 121.235 -0.507 . . . . 73.230000000000004 112.463 176.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 79.6 mtp -86.72 -55.4 3.88 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.706 0.288 . . . . 72.010000000000005 111.177 176.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.93 -33.15 66.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.783 0.66 . . . . 52.530000000000001 112.783 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.445 ' HE ' ' HA2' ' A' ' 61' ' ' GLY . 53.2 ptt85 -64.12 -30.84 71.88 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.941 -0.304 . . . . 74.319999999999993 111.543 178.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.04 -4.04 28.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 122.152 -0.343 . . . . 72.030000000000001 111.748 177.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.95 -71.86 0.66 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.068 0.461 . . . . 71.430000000000007 110.532 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 44.27 87.73 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.095 0.958 . . . . 72.129999999999995 112.517 -177.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.561 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.8 mp -70.19 115.41 9.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 115.881 -0.6 . . . . 74.349999999999994 111.701 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.56 -14.97 13.14 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.394 0.516 . . . . 75.409999999999997 112.394 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -148.52 172.6 14.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.227 -0.296 . . . . 70.120000000000005 111.075 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.6 -29.62 70.74 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.354 0.501 . . . . 64.109999999999999 112.354 -175.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.59 -39.57 88.59 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.769 0.319 . . . . 71.310000000000002 110.868 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.561 ' HB2' HG23 ' A' ' 68' ' ' ILE . 55.6 m-20 -59.65 -40.47 87.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.148 0.499 . . . . 73.239999999999995 110.562 175.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.4 t -58.53 -46.48 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 116.068 -0.515 . . . . 71.439999999999998 111.142 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.18 -32.43 73.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.91 0.386 . . . . 74.129999999999995 111.149 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -65.48 -37.71 87.61 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.932 0.396 . . . . 55.140000000000001 110.372 174.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -60.01 -37.85 80.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.353 -0.385 . . . . 72.439999999999998 110.964 174.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -53.48 -42.67 67.48 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.957 0.408 . . . . 65.140000000000001 110.851 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 mmm-85 -59.91 -46.67 88.61 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.189 -0.459 . . . . 64.329999999999998 110.474 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.2 t -58.97 -39.16 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.891 0.377 . . . . 42.420000000000002 111.168 177.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.555 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.8 mmt -58.67 -38.02 77.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.166 0.508 . . . . 71.230000000000004 110.857 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.72 -38.94 74.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.978 -0.555 . . . . 72.239999999999995 110.904 173.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -68.89 -29.74 68.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.162 -0.472 . . . . 64.109999999999999 111.493 178.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 82.3 t -63.84 -28.27 44.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 120.901 0.381 . . . . 72.450000000000003 111.165 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 52.4 m-85 . . . . . 0 N--CA 1.471 0.617 0 N-CA-C 112.452 0.538 . . . . 64.140000000000001 112.452 177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.9 m95 . . . . . 0 N--CA 1.478 0.929 0 N-CA-C 113.174 0.805 . . . . 70.019999999999996 113.174 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.78 -24.37 33.02 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.448 -0.406 . . . . 64.019999999999996 112.805 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 2.3 mmp_? -57.47 -44.09 84.56 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.697 0.284 . . . . 73.450000000000003 111.078 174.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.8 mm -65.61 -49.96 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.026 0.441 . . . . 74.140000000000001 110.994 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' A' ' 146' ' ' PHE . 61.6 t -54.29 -52.87 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.006 -0.543 . . . . 74.329999999999998 111.276 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -58.04 -42.65 85.86 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 111.662 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.523 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 29.5 tp -58.83 -54.98 40.99 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.276 0.56 . . . . 43.310000000000002 111.552 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.5 mt -69.97 -35.58 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.038 -0.528 . . . . 75.120000000000005 111.501 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.3 m -65.71 -44.73 85.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.583 -0.28 . . . . 70.430000000000007 111.185 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 105' ' ' VAL . 30.8 t80 -61.7 -43.43 98.87 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.676 0.274 . . . . 74.439999999999998 110.809 176.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -46.08 93.14 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 120.92 -0.657 . . . . 60.409999999999997 112.481 175.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -34.02 76.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.914 0.387 . . . . 65.109999999999999 111.519 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -65.41 -45.72 82.82 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.322 -0.399 . . . . 73.219999999999999 110.703 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 46.1 t -66.37 -36.62 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 110.085 -0.339 . . . . 54.509999999999998 110.085 175.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.74 -43.72 85.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.179 -0.464 . . . . 64.430000000000007 111.534 175.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 97.5 mttt -55.42 -46.9 76.63 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.328 0.585 . . . . 73.209999999999994 110.716 174.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.412 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.9 t60 -64.7 -34.6 78.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.13 -0.487 . . . . 71.549999999999997 111.345 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.527 HD21 ' HB ' ' A' ' 68' ' ' ILE . 80.0 mt -64.45 -49.89 69.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.496 0.189 . . . . 75.430000000000007 111.446 178.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.459 ' O ' ' HD3' ' A' ' 110' ' ' LYS . 8.3 tmtm? -57.85 -39.44 77.73 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.209 0.528 . . . . 73.219999999999999 109.802 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 m -60.52 -33.58 72.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.07 -0.514 . . . . 65.530000000000001 111.817 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.5 pt -106.28 24.97 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 112.573 0.582 . . . . 64.239999999999995 112.573 -177.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 63.52 36.77 10.94 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.735 0.642 . . . . 62.399999999999999 112.735 175.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -117.32 33.01 5.83 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.746 0.308 . . . . 73.439999999999998 111.705 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.16 -30.97 40.2 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.104 0.409 . . . . 60.219999999999999 112.104 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.403 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 50.9 m -67.48 -37.12 82.39 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.775 0.321 . . . . 65.040000000000006 111.054 177.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.9 m -65.79 -27.2 68.1 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.093 0.405 . . . . 72.140000000000001 112.093 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.38 -39.28 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 112.476 0.547 . . . . 73.109999999999999 112.476 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -66.15 -55.54 20.49 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.604 0.594 . . . . 73.329999999999998 112.604 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.2 Cg_endo -59.78 -26.33 81.91 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 121.736 1.624 . . . . 72.5 112.113 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.3 tt -65.29 -48.22 73.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.811 -0.44 . . . . 63.520000000000003 109.811 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.14 -38.59 80.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.099 0.476 . . . . 73.209999999999994 111.226 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.39 -40.54 96.81 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 53.409999999999997 111.069 174.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.9 m -62.1 -46.66 88.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.799 0.333 . . . . 73.040000000000006 111.163 177.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 121' ' ' LEU . 45.8 mm -54.75 -51.9 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.283 0.563 . . . . 73.209999999999994 110.97 176.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.2 m -66.62 -39.2 88.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.812 -0.631 . . . . 60.240000000000002 111.89 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.603 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 30.5 t70 -59.54 -53.58 56.49 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.78 -0.191 . . . . 75.150000000000006 110.798 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.435 ' O ' HG22 ' A' ' 132' ' ' THR . 62.3 t -61.55 -43.43 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 120.908 0.385 . . . . 65.230000000000004 111.044 178.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.636 ' HG ' HD11 ' A' ' 137' ' ' LEU . 35.6 tp -49.6 -52.48 30.05 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.922 -0.581 . . . . 72.219999999999999 111.53 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.16 -34.51 26.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.332 0.586 . . . . 34.240000000000002 111.387 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 50.7 ttt180 -58.4 -33.36 69.56 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.831 0.852 . . . . 72.540000000000006 112.872 -174.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.642 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -116.66 -14.36 10.83 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.852 1.056 . . . . 51.340000000000003 113.852 -177.683 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.786 ' HZ2' ' HB3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.33 48.9 0.9 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.537 0.94 . . . . 71.25 113.537 174.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -51.69 -60.53 3.06 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.319 0.489 . . . . 74.109999999999999 112.319 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.82 -47.23 85.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.356 -0.384 . . . . 64.420000000000002 111.961 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 133' ' ' LYS . 95.3 m95 -53.32 -38.87 63.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.873 0.323 . . . . 74.329999999999998 111.873 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.636 HD11 ' HG ' ' A' ' 129' ' ' LEU . 46.0 mt -54.05 -51.13 65.03 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.228 -0.442 . . . . 74.349999999999994 112.167 177.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.68 -43.61 25.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 O-C-N 121.94 -0.475 . . . . 63.119999999999997 112.244 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -54.21 -52.63 60.65 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.174 0.512 . . . . 70.019999999999996 111.631 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -93.77 5.12 52.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.488 . . . . 72.439999999999998 111.43 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 59.31 38.76 23.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.38 -0.373 . . . . 73.310000000000002 111.945 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -27.04 -49.33 0.06 OUTLIER Glycine 0 N--CA 1.471 1.022 0 N-CA-C 116.238 1.255 . . . . 54.350000000000001 116.238 -173.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.423 ' O ' HG23 ' A' ' 147' ' ' VAL . 13.0 m95 -67.45 -51.39 52.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 117.733 0.766 . . . . 71.230000000000004 111.716 -178.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.82 -29.07 68.9 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.905 0.383 . . . . 73.439999999999998 111.11 174.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.546 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -69.43 -37.88 79.58 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.944 -0.463 . . . . 72.409999999999997 111.944 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . 0.408 ' CE1' HG22 ' A' ' 96' ' ' VAL . 19.1 t80 -60.45 -41.4 94.0 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.175 0.512 . . . . 71.329999999999998 110.88 173.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.513 HG21 ' HG3' ' A' ' 39' ' ' LYS . 58.4 t -70.73 -38.21 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 116.033 -0.53 . . . . 74.420000000000002 112.314 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.546 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.4 pt-20 -74.0 -40.07 63.2 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 122.274 -0.266 . . . . 71.540000000000006 111.629 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -58.24 -48.34 80.71 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.978 0.418 . . . . 62.409999999999997 111.463 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -80.75 -9.13 59.83 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.439 -0.346 . . . . 73.010000000000005 111.148 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 67.5 t60 57.93 63.02 1.89 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.458 0.647 . . . . 72.430000000000007 112.19 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.533 HG21 HG23 ' A' ' 43' ' ' THR . 87.4 t . . . . . 0 N--CA 1.467 0.416 0 CA-C-N 115.979 -0.555 . . . . 63.520000000000003 110.21 177.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 120.675 0.274 . . . . 75.030000000000001 111.547 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.6 -41.0 98.36 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.074 0.398 . . . . 74.120000000000005 112.074 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 ' HB3' ' A' ' 137' ' ' LEU . 63.4 tp -60.26 -41.58 93.54 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.702 0.287 . . . . 74.340000000000003 110.615 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -57.06 -49.04 77.08 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.272 -0.422 . . . . 74.409999999999997 110.82 174.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -63.73 -43.49 96.34 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.884 0.373 . . . . 73.340000000000003 111.714 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.443 ' O ' HG13 ' A' ' 12' ' ' ILE . 54.3 tt0 -62.66 -52.24 64.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.159 0.504 . . . . 71.200000000000003 111.308 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.1 p -61.61 -44.39 97.08 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.007 -0.542 . . . . 75.340000000000003 111.09 177.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.3 tp -53.61 -45.04 69.92 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.232 -0.44 . . . . 54.25 111.44 175.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.21 -51.43 69.02 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.715 0.293 . . . . 64.530000000000001 111.571 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 8' ' ' GLN . 62.9 mt -55.8 -51.89 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.117 0.484 . . . . 75.450000000000003 111.386 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.405 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.8 mt -66.72 -49.76 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.996 -0.547 . . . . 71.109999999999999 112.195 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 87.9 p -55.5 -47.84 75.56 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.88 0.371 . . . . 75.409999999999997 111.601 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -62.55 -41.94 99.22 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.406 -0.361 . . . . 73.049999999999997 111.615 178.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.415 ' OH ' ' HA3' ' A' ' 48' ' ' GLY . 56.0 t80 -61.07 -46.49 90.47 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.904 0.383 . . . . 74.319999999999993 111.043 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.1 mp -63.52 -34.56 78.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.47 -0.332 . . . . 64.519999999999996 111.601 177.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -62.95 -54.06 44.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.62 0.248 . . . . 65.439999999999998 111.477 176.552 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.0 -35.33 79.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.097 0.475 . . . . 74.010000000000005 111.624 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' A' ' 107' ' ' LYS . 71.6 mm-40 -72.37 -28.07 62.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.839 0.352 . . . . 73.040000000000006 111.724 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.6 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -72.89 -39.16 66.61 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 121.224 0.535 . . . . 74.200000000000003 110.928 175.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.5 p -87.62 -20.12 26.81 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.92 -0.582 . . . . 62.439999999999998 111.849 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.805 0 C-N-CA 121.654 -0.308 . . . . 31.010000000000002 113.779 175.692 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.746 0 CA-C-O 120.703 0.057 . . . . 60.350000000000001 113.167 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.1 70.21 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.996 0.739 . . . . 65.420000000000002 112.996 -173.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.1 m -54.7 -54.18 45.24 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 120.955 0.407 . . . . 73.540000000000006 111.856 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.2 m -71.85 -31.48 66.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.461 -0.336 . . . . 72.430000000000007 111.867 -177.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.3 tpt85 -64.02 -48.02 77.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 120.655 0.264 . . . . 65.310000000000002 111.438 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.425 ' HG3' HG21 ' A' ' 147' ' ' VAL . 6.1 ptmm? -76.2 -27.78 57.01 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.71 0.291 . . . . 65.200000000000003 111.41 178.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.57 -52.97 48.34 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.837 0.351 . . . . 61.219999999999999 110.948 174.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.5 tp -61.39 -38.27 86.43 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.176 0.512 . . . . 74.340000000000003 110.816 176.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.27 -40.52 90.67 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.92 -0.582 . . . . 64.030000000000001 110.827 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.621 HG23 HG21 ' A' ' 152' ' ' VAL . 93.6 m -69.64 -45.54 68.24 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.106 -0.497 . . . . 74.140000000000001 111.202 176.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.2 mt -54.28 -46.34 72.68 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.504 0.557 . . . . 72.209999999999994 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 45' ' ' ARG . 6.5 ptp180 -65.58 -34.11 77.48 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.152 -0.342 . . . . 73.120000000000005 111.447 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -73.07 -44.84 60.02 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 111.941 0.349 . . . . 74.409999999999997 111.941 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 51' ' ' VAL . 33.5 m -79.72 -34.12 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.793 0.33 . . . . 74.129999999999995 111.329 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' OH ' ' A' ' 16' ' ' TYR . . . -66.12 -39.35 94.59 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 121.459 -0.401 . . . . 53.299999999999997 112.859 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.99 -45.63 61.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.974 0.416 . . . . 72.349999999999994 111.417 174.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.44 -51.16 10.09 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 120.985 -0.626 . . . . 61.119999999999997 112.987 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.455 ' HA ' HD21 ' A' ' 54' ' ' ASN . 75.5 t -57.44 -53.48 43.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.372 0.508 . . . . 50.109999999999999 112.372 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -59.88 -44.81 93.99 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.204 0.446 . . . . 64.349999999999994 112.204 -177.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -65.44 -33.72 76.61 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.098 0.777 . . . . 74.109999999999999 113.098 -175.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.455 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.9 p30 -84.6 -34.14 23.21 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.336 -0.853 . . . . 74.420000000000002 111.062 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -75.47 -18.18 59.93 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.213 0.449 . . . . 72.310000000000002 112.213 177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.86 -55.19 10.37 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.644 0.609 . . . . 73.439999999999998 112.644 -174.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.8 t -58.93 -35.25 72.79 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.141 0.422 . . . . 62.219999999999999 112.141 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.72 -53.27 23.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.828 0.346 . . . . 74.109999999999999 111.649 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -63.92 -33.01 74.74 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.532 -0.303 . . . . 72.319999999999993 111.736 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 41.4 mm-40 -47.76 -46.79 30.56 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.554 0.216 . . . . 63.409999999999997 111.297 176.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.3 -41.07 61.64 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 121.233 -0.508 . . . . 74.109999999999999 112.913 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.466 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.9 mtp -70.51 -40.88 73.25 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.037 0.446 . . . . 75.310000000000002 111.081 178.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -62.2 -26.89 68.61 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.494 -0.321 . . . . 74.439999999999998 111.799 176.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 33.4 mtm180 -60.77 -26.57 67.33 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.233 0.457 . . . . 73.019999999999996 112.233 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 62' ' ' MET . 56.3 pttt -94.71 -8.98 36.19 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.863 0.363 . . . . 52.229999999999997 111.209 176.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.481 HD13 HD21 ' A' ' 77' ' ' LEU . 93.8 mt -105.92 -84.78 0.5 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.581 0.585 . . . . 71.219999999999999 112.581 -173.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.75 -22.41 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.529 0.937 . . . . 72.129999999999995 113.529 -173.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.4 mp 59.34 95.65 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.659 0.783 . . . . 75.319999999999993 112.456 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.79 -8.65 18.62 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.604 . . . . 74.340000000000003 111.443 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.448 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.35 -179.71 7.61 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.377 -0.374 . . . . 71.219999999999999 110.674 175.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 34.8 tt0 -59.74 -37.26 78.47 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.837 0.31 . . . . 65.439999999999998 111.837 -178.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -54.28 -36.13 63.32 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 111.863 0.32 . . . . 72.239999999999995 111.863 -174.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -61.75 -44.39 97.0 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.317 0.58 . . . . 73.540000000000006 110.618 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.03 -36.97 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 121.265 0.555 . . . . 60.020000000000003 110.828 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.6 mmmt -65.13 -31.34 72.49 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.025 0.44 . . . . 71.319999999999993 110.577 176.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -67.78 -40.39 83.97 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.059 0.456 . . . . 74.530000000000001 110.609 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.573 ' O ' ' HG2' ' A' ' 81' ' ' MET . 96.7 mt -55.91 -40.3 72.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.133 -0.485 . . . . 71.219999999999999 110.93 175.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.8 t -54.86 -44.5 74.06 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.018 0.437 . . . . 34.329999999999998 111.069 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -57.92 -44.23 86.75 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.147 -0.479 . . . . 74.420000000000002 110.803 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 84' ' ' VAL . 57.6 t -61.08 -41.81 90.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.207 -0.452 . . . . 64.0 111.131 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.4 mmt -57.7 -43.89 85.47 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.07 0.462 . . . . 62.119999999999997 111.241 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 68.6 mt -56.13 -41.27 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.232 0.539 . . . . 73.230000000000004 110.87 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.76 -26.35 59.71 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.447 0.536 . . . . 72.209999999999994 112.447 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 80' ' ' VAL . 78.8 t -55.91 -33.09 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.135 0.493 . . . . 74.540000000000006 111.178 174.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.493 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.3 m-85 . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 112.485 0.55 . . . . 60.030000000000001 112.485 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.404 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.1 m95 . . . . . 0 CA--C 1.54 0.559 0 CA-C-O 120.625 0.25 . . . . 71.420000000000002 111.413 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.46 -35.79 51.96 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 121.428 -0.415 . . . . 63.100000000000001 113.225 177.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -54.82 -40.41 69.53 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 111.998 0.37 . . . . 72.239999999999995 111.998 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.401 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.8 mm -66.64 -46.47 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 120.905 0.383 . . . . 52.299999999999997 110.839 177.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.7 t -57.93 -43.33 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 120.978 0.418 . . . . 74.140000000000001 110.838 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.1 m -59.82 -42.25 93.09 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.168 -0.469 . . . . 63.210000000000001 111.239 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.528 HD12 ' SD ' ' A' ' 81' ' ' MET . 29.1 tp -59.54 -54.67 43.82 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.258 0.552 . . . . 53.32 111.67 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.4 mt -69.7 -39.99 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 115.991 -0.549 . . . . 73.409999999999997 111.873 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.2 p -63.45 -45.76 89.38 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.593 -0.276 . . . . 72.329999999999998 111.743 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.66 -43.27 93.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.795 0.331 . . . . 72.140000000000001 111.018 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.43 -45.47 92.93 Favored Glycine 0 CA--C 1.529 0.906 0 C-N-CA 120.904 -0.665 . . . . 61.399999999999999 112.314 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.34 -35.32 80.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.113 0.482 . . . . 73.230000000000004 111.647 177.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -64.75 -40.82 95.93 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.151 -0.477 . . . . 73.140000000000001 111.242 178.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 59.9 t -71.9 -38.44 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 120.838 0.352 . . . . 72.120000000000005 110.673 176.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.43 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.68 0.622 . . . . 73.129999999999995 112.68 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -61.27 -38.89 88.38 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.849 0.357 . . . . 71.510000000000005 111.494 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.437 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.4 t60 -65.59 -36.71 84.54 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.746 0.308 . . . . 74.349999999999994 110.703 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 81.4 mt -62.95 -50.44 70.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.489 -0.323 . . . . 42.219999999999999 111.859 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.836 0.35 . . . . 51.030000000000001 111.075 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.2 m -57.48 -37.82 73.53 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.403 -0.362 . . . . 53.420000000000002 111.737 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.6 pt -97.56 21.66 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 120.913 0.387 . . . . 70.239999999999995 111.646 177.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 68.75 6.81 5.75 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.637 0.977 . . . . 72.010000000000005 113.637 174.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -82.87 40.92 0.71 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.281 0.474 . . . . 63.119999999999997 112.281 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.0 -33.01 72.58 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.859 -0.526 . . . . 74.310000000000002 111.27 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 38.8 m -56.74 -28.09 60.51 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.519 -0.31 . . . . 73.310000000000002 111.435 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.9 m -79.24 -27.04 42.4 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.769 0.318 . . . . 74.430000000000007 111.834 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.5 mt -59.73 -41.39 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.482 0.549 . . . . 74.319999999999993 112.482 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -62.2 -56.42 31.26 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 112.402 0.519 . . . . 65.319999999999993 112.402 -178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.19 -30.23 90.82 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.846 1.697 . . . . 62.329999999999998 112.419 176.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -64.14 -50.18 69.22 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 109.66 -0.496 . . . . 61.420000000000002 109.66 174.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.75 -41.54 77.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.008 -0.542 . . . . 74.340000000000003 111.381 177.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -61.91 -46.19 90.46 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.448 -0.342 . . . . 71.310000000000002 111.009 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.9 m -56.4 -38.34 71.39 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.206 0.447 . . . . 44.049999999999997 112.206 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.4 mm -57.2 -53.88 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.204 0.526 . . . . 72.409999999999997 111.014 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 38.3 m -71.41 -33.76 69.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.935 -0.575 . . . . 71.540000000000006 111.453 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -59.82 -51.58 69.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.165 -0.471 . . . . 73.450000000000003 111.163 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.614 ' O ' HG22 ' A' ' 132' ' ' THR . 63.1 t -64.29 -48.89 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 120.87 0.367 . . . . 64.450000000000003 110.633 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.59 ' HG ' HD11 ' A' ' 137' ' ' LEU . 59.8 tp -49.21 -52.65 25.58 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.878 -0.601 . . . . 73.340000000000003 111.817 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.589 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -66.28 -52.24 49.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.231 -0.441 . . . . 55.009999999999998 111.519 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 131' ' ' ARG . 42.3 ttm105 -48.18 -46.08 34.42 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.89 0.7 . . . . 71.129999999999995 112.89 -176.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 128' ' ' VAL . 3.8 t -99.93 -28.76 12.93 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.082 1.141 . . . . 73.010000000000005 114.082 -173.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.57 ' HD2' HG23 ' A' ' 132' ' ' THR . 1.4 mptp? -131.82 31.05 4.27 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.529 0.937 . . . . 75.040000000000006 113.529 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.589 ' HD3' HG13 ' A' ' 130' ' ' VAL . 37.3 tpt85 -54.5 -45.96 73.37 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.018 0.437 . . . . 73.430000000000007 111.754 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.11 -50.85 72.47 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.049 -0.523 . . . . 62.350000000000001 111.703 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -57.79 -37.09 73.1 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 111.956 0.354 . . . . 74.209999999999994 111.956 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.59 HD11 ' HG ' ' A' ' 129' ' ' LEU . 77.6 mt -57.16 -48.56 78.4 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.11 0.411 . . . . 74.319999999999993 112.11 177.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.19 -36.83 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 122.156 -0.34 . . . . 61.310000000000002 111.753 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.45 -53.36 59.06 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.009 0.433 . . . . 75.099999999999994 111.865 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -93.89 7.01 46.59 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.118 0.414 . . . . 73.209999999999994 112.118 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 52.97 54.51 10.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.017 0.437 . . . . 72.530000000000001 110.509 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.404 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -30.94 -56.69 0.27 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 115.964 1.146 . . . . 71.209999999999994 115.964 -170.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.506 ' O ' HG23 ' A' ' 147' ' ' VAL . 18.6 m95 -69.87 -44.19 70.31 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 117.388 0.594 . . . . 74.510000000000005 112.548 -173.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.65 -51.2 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.927 0.394 . . . . 74.430000000000007 111.14 174.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.14 -38.37 85.52 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 116.059 -0.519 . . . . 61.140000000000001 112.803 178.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -57.83 -53.79 54.28 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.037 0.446 . . . . 64.230000000000004 111.527 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 143' ' ' TRP . 29.8 t -66.02 -42.5 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.135 0.42 . . . . 72.439999999999998 112.135 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.427 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.3 pt-20 -70.43 -34.15 72.15 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 122.168 -0.332 . . . . 63.200000000000003 111.544 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -62.2 -47.48 84.25 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.994 0.426 . . . . 73.340000000000003 110.816 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -79.78 -4.63 52.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.304 -0.407 . . . . 74.239999999999995 111.391 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.7 p80 43.02 39.75 1.94 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.109 0.963 . . . . 71.219999999999999 112.964 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.621 HG21 HG23 ' A' ' 43' ' ' THR . 56.1 t . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 116.581 -0.281 . . . . 75.540000000000006 111.39 178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 CA--C 1.547 0.836 0 CA-C-O 120.311 0.101 . . . . 73.209999999999994 111.025 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.53 -46.18 77.1 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.016 0.436 . . . . 73.049999999999997 111.26 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.55 -34.11 70.67 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.109 -0.496 . . . . 63.140000000000001 110.773 177.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.406 ' HE2' ' HA ' ' A' ' 127' ' ' ASP . 11.1 t80 -67.23 -43.4 82.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.963 -0.562 . . . . 62.32 110.536 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 7' ' ' ARG . 7.7 mmt180 -67.85 -43.63 79.01 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.189 0.44 . . . . 74.319999999999993 112.189 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -58.0 -50.85 71.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.208 0.528 . . . . 64.349999999999994 110.693 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.3 p -64.04 -51.89 62.02 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.907 -0.588 . . . . 63.25 111.544 178.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 61.7 tp -51.98 -42.73 63.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 111.857 0.317 . . . . 74.430000000000007 111.857 177.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -57.78 -52.83 63.87 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.124 0.488 . . . . 74.329999999999998 111.044 177.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.51 -48.38 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.851 -0.613 . . . . 71.439999999999998 111.897 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 99' ' ' ILE . 75.3 mt -64.09 -52.52 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.359 -0.382 . . . . 65.340000000000003 111.968 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.7 p -52.78 -47.72 67.33 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.807 0.337 . . . . 73.010000000000005 111.637 -178.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 74.6 mtt180 -57.52 -51.26 70.17 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.648 -0.251 . . . . 63.130000000000003 110.8 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -53.22 -39.27 63.63 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.02 0.378 . . . . 72.430000000000007 112.02 -177.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.9 mp -62.93 -46.14 89.17 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.57 0.211 . . . . 73.109999999999999 111.57 176.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.67 -34.69 78.88 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.118 -0.364 . . . . 70.310000000000002 111.356 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.0 mm-40 -56.63 -51.76 67.47 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.306 0.574 . . . . 73.310000000000002 111.114 176.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.4 ' HB3' ' HE2' ' A' ' 107' ' ' LYS . 27.8 mm-40 -77.97 -23.42 48.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.962 -0.563 . . . . 70.349999999999994 112.495 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.01 -48.27 21.66 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.978 0.418 . . . . 64.209999999999994 111.59 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.445 HG22 ' HE3' ' A' ' 110' ' ' LYS . 32.8 p -92.07 -38.77 12.01 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.095 0.405 . . . . 60.0 112.095 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.842 0 C-N-CA 121.217 -0.516 . . . . 65.150000000000006 112.696 -175.076 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.604 0 CA-C-O 120.562 -0.021 . . . . 35.240000000000002 113.122 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.77 -50.11 71.33 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 111.837 0.31 . . . . 53.100000000000001 111.837 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -61.68 -53.25 58.59 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.015 0.376 . . . . 54.240000000000002 112.015 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.2 m -60.83 -33.06 72.46 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.842 0.353 . . . . 64.5 111.635 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 -68.03 -56.53 8.57 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.841 0.353 . . . . 73.439999999999998 111.408 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 16.9 ptmt -64.41 -32.05 73.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.403 -0.362 . . . . 72.030000000000001 111.518 -177.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -47.5 78.9 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.842 0.354 . . . . 70.430000000000007 111.089 175.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HG ' HH21 ' A' ' 45' ' ' ARG . 51.7 tp -64.67 -38.0 89.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.286 0.476 . . . . 73.019999999999996 112.286 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 12.1 pt-20 -75.79 -34.67 60.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.002 -0.436 . . . . 73.030000000000001 111.415 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.536 ' OG1' HG21 ' A' ' 152' ' ' VAL . 56.8 m -67.47 -38.67 84.75 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.083 -0.386 . . . . 53.509999999999998 111.138 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.64 -43.87 69.12 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.925 0.342 . . . . 74.409999999999997 111.925 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.504 HH21 ' HG ' ' A' ' 41' ' ' LEU . 16.0 ptp180 -78.72 -36.65 43.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.828 0.346 . . . . 74.219999999999999 111.176 177.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.483 ' NH1' HG13 ' A' ' 152' ' ' VAL . 32.4 ttt180 -57.12 -43.13 82.03 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.169 0.587 . . . . 74.420000000000002 112.163 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -101.59 -33.96 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.855 0.36 . . . . 63.520000000000003 111.642 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.454 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -61.96 -35.9 92.07 Favored Glycine 0 C--N 1.333 0.375 0 CA-C-N 116.317 -0.401 . . . . 75.109999999999999 113.614 -177.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 28.4 t70 -54.68 -55.49 29.13 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.064 0.459 . . . . 75.299999999999997 110.981 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.05 99.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.13 -0.557 . . . . 53.409999999999997 112.752 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 47' ' ' VAL . 65.6 t -57.28 -46.98 85.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 O-C-N 122.659 -0.318 . . . . 70.219999999999999 111.504 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.9 mt-30 -55.86 -46.66 78.18 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.655 0.264 . . . . 44.149999999999999 111.158 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 35.3 mtp85 -60.92 -41.12 95.55 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.179 0.437 . . . . 63.109999999999999 112.179 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -71.48 -37.57 71.29 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.242 0.544 . . . . 74.019999999999996 111.496 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -83.83 -19.05 35.62 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.646 0.61 . . . . 64.310000000000002 112.646 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 38.9 tt0 -49.17 -55.3 12.85 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.298 0.481 . . . . 64.319999999999993 112.298 -174.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -52.17 -34.78 46.5 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.904 0.383 . . . . 61.340000000000003 112.0 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.47 -42.39 59.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.87 0.367 . . . . 72.430000000000007 111.719 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -69.87 -34.36 73.48 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.12 0.415 . . . . 73.319999999999993 112.12 -178.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 84.0 mm-40 -51.04 -38.24 50.24 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.084 0.469 . . . . 71.140000000000001 111.322 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.508 ' HA2' HH11 ' A' ' 64' ' ' ARG . . . -58.67 -33.0 70.62 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.01 -0.541 . . . . 75.420000000000002 113.861 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.486 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 71.0 mtm -90.05 -45.31 9.24 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.293 -0.533 . . . . 75.319999999999993 111.717 178.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.22 -29.52 61.11 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.517 0.562 . . . . 65.019999999999996 112.517 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.508 HH11 ' HA2' ' A' ' 61' ' ' GLY . 18.3 ptt-85 -65.24 -19.0 65.76 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.748 0.309 . . . . 63.119999999999997 111.737 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.0 3.46 8.69 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.881 0.697 . . . . 64.25 112.881 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 62' ' ' MET . 82.5 mt -90.25 -77.32 0.4 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.904 0.335 . . . . 73.019999999999996 111.904 178.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 52.52 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.654 0.74 . . . . 73.430000000000007 112.49 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.53 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -77.86 99.12 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 115.62 -0.718 . . . . 62.439999999999998 110.532 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.86 -9.87 16.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.961 -0.563 . . . . 72.549999999999997 112.194 -176.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.46 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -157.46 173.75 16.43 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.845 0.355 . . . . 61.5 111.431 173.266 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -56.53 -39.67 73.77 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.16 0.8 . . . . 62.299999999999997 113.16 -171.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -54.34 -34.46 61.1 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.739 0.304 . . . . 52.030000000000001 111.344 -177.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.53 ' HB2' HG23 ' A' ' 68' ' ' ILE . 49.3 m-20 -63.39 -46.25 87.31 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.025 0.441 . . . . 60.109999999999999 110.849 176.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 80.3 t -58.28 -46.07 89.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.378 0.608 . . . . 73.219999999999999 110.512 176.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 6.6 mtpm? -64.16 -28.0 69.46 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.765 -0.652 . . . . 75.5 110.915 177.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 55.4 m -73.03 -36.36 66.95 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.897 0.379 . . . . 42.299999999999997 110.789 174.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -61.72 -37.09 82.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.482 -0.326 . . . . 72.420000000000002 110.896 175.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 t -52.78 -39.52 62.35 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.188 0.518 . . . . 71.530000000000001 111.135 176.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -62.6 -38.78 91.53 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.926 -0.579 . . . . 72.420000000000002 110.896 177.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.71 -42.89 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.876 0.369 . . . . 73.329999999999998 110.74 175.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 20.7 mmt -54.96 -40.98 70.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.017 -0.538 . . . . 74.340000000000003 111.256 178.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.2 -43.05 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.091 -0.504 . . . . 72.109999999999999 111.013 175.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -67.06 -28.77 68.47 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.087 -0.506 . . . . 70.030000000000001 112.064 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 91.8 t -55.46 -35.05 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.112 0.482 . . . . 55.420000000000002 111.366 177.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.532 ' HA ' ' NH2' ' A' ' 94' ' ' ARG . 73.8 m-85 . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 112.128 0.418 . . . . 64.299999999999997 112.128 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.459 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 94.0 m95 . . . . . 0 N--CA 1.473 0.702 0 N-CA-C 111.875 0.324 . . . . 73.319999999999993 111.875 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.74 -24.59 49.12 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.276 -0.488 . . . . 73.0 112.999 174.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.532 ' NH2' ' HA ' ' A' ' 85' ' ' PHE . 73.1 mtp180 -66.65 -43.04 85.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.938 0.399 . . . . 74.150000000000006 110.452 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.72 -43.44 95.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.217 0.532 . . . . 74.25 110.297 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.1 t -60.54 -42.71 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.929 -0.578 . . . . 54.32 110.959 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.9 m -60.87 -42.56 98.13 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.93 0.395 . . . . 63.340000000000003 111.162 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 27.0 tp -59.66 -54.64 44.1 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.263 0.554 . . . . 73.349999999999994 111.515 177.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 13' ' ' ILE . 59.4 mt -69.1 -37.84 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-N 116.073 -0.512 . . . . 72.049999999999997 111.746 -177.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.5 p -65.6 -40.37 92.6 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.33 -0.231 . . . . 55.32 111.311 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -62.22 -42.3 99.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.666 0.27 . . . . 65.340000000000003 110.506 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.76 -47.2 87.44 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.914 -0.66 . . . . 44.549999999999997 112.219 174.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 107' ' ' LYS . . . -66.42 -34.65 78.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.946 0.403 . . . . 50.219999999999999 111.582 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -64.87 -45.51 85.7 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.044 0.449 . . . . 73.540000000000006 110.679 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.75 -37.49 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 116.335 -0.393 . . . . 63.310000000000002 110.584 175.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.74 -40.85 66.49 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 111.793 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 93.7 mttt -57.28 -49.36 76.34 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.111 0.482 . . . . 75.200000000000003 110.651 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.438 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.5 t60 -64.68 -33.2 75.39 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.103 -0.499 . . . . 72.430000000000007 110.996 178.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.508 HD21 ' HB ' ' A' ' 68' ' ' ILE . 76.6 mt -62.95 -50.78 69.47 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.619 -0.264 . . . . 73.340000000000003 111.44 177.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.6 tttm -65.39 -27.41 68.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.984 0.421 . . . . 70.409999999999997 110.609 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.1 m -65.66 -31.67 72.82 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 111.382 175.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.8 pt -108.77 36.34 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-O 120.777 0.322 . . . . 73.299999999999997 111.455 177.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 p30 47.7 20.41 0.2 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.225 1.194 . . . . 51.399999999999999 114.225 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.17 35.71 0.81 Allowed 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.203 0.525 . . . . 74.530000000000001 110.879 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -56.69 -39.24 73.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.008 -0.542 . . . . 73.340000000000003 112.105 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 79.1 p -65.37 -27.63 68.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.491 -0.322 . . . . 55.25 111.643 178.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.5 m -68.57 -26.4 65.38 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.545 0.338 . . . . 74.099999999999994 111.81 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.23 -40.78 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 N-CA-C 112.62 0.6 . . . . 60.32 112.62 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.95 -52.52 23.87 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 112.852 0.686 . . . . 51.420000000000002 112.852 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.14 -27.14 84.27 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.88 1.72 . . . . 64.450000000000003 112.159 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.65 -46.36 82.86 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 109.831 -0.433 . . . . 64.409999999999997 109.831 172.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.56 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.07 -39.4 78.43 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.02 0.438 . . . . 61.149999999999999 111.132 174.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.62 -43.17 97.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.405 -0.361 . . . . 64.0 110.943 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.2 m -58.71 -47.47 84.44 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.886 0.374 . . . . 72.340000000000003 111.015 177.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.8 mm -52.7 -52.51 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.44 0.638 . . . . 63.409999999999997 111.087 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.8 m -67.04 -38.41 85.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.421 -0.809 . . . . 70.349999999999994 112.261 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.406 ' HA ' ' HE2' ' A' ' 6' ' ' TYR . 30.1 t70 -64.07 -51.15 65.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.674 0.273 . . . . 65.329999999999998 110.889 -178.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 67.0 t -60.4 -33.85 55.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.371 0.605 . . . . 65.420000000000002 110.944 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.546 ' HG ' HD11 ' A' ' 137' ' ' LEU . 38.8 tp -66.12 -54.04 30.52 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.999 -0.546 . . . . 74.530000000000001 111.917 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.447 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 61.5 t -76.49 -29.63 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 111.941 0.349 . . . . 65.200000000000003 111.941 -176.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.56 -49.94 66.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.989 0.423 . . . . 63.210000000000001 112.122 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.532 ' OG1' ' HD3' ' A' ' 133' ' ' LYS . 10.5 p -109.99 -39.23 5.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 75.319999999999993 112.402 -175.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.532 ' HD3' ' OG1' ' A' ' 132' ' ' THR . 2.7 mppt? -82.46 10.79 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.294 0.479 . . . . 72.340000000000003 112.294 -177.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 20.9 tpt180 -45.71 -61.24 1.79 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.849 0.685 . . . . 64.329999999999998 112.849 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.05 -49.06 79.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.071 0.462 . . . . 64.340000000000003 111.363 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -60.68 -36.93 79.97 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.156 -0.475 . . . . 72.409999999999997 111.996 -177.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.546 HD11 ' HG ' ' A' ' 129' ' ' LEU . 29.7 mt -59.35 -54.48 46.26 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.685 0.254 . . . . 73.219999999999999 111.685 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.8 p -71.11 -38.44 71.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 112.027 0.38 . . . . 54.149999999999999 112.027 -178.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -63.12 -46.02 89.27 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.122 0.416 . . . . 72.120000000000005 112.122 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -94.65 6.23 49.48 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.995 0.426 . . . . 73.430000000000007 111.317 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 62.05 26.63 16.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.92 -0.582 . . . . 63.450000000000003 112.281 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.459 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 25.83 -83.09 0.0 OUTLIER Glycine 0 N--CA 1.468 0.787 0 N-CA-C 115.903 1.121 . . . . 73.319999999999993 115.903 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.402 ' O ' HG23 ' A' ' 147' ' ' VAL . 12.5 m95 -75.34 -38.17 60.31 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.124 0.416 . . . . 62.020000000000003 112.124 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 20.0 m-20 -64.69 -48.08 76.01 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.922 -0.399 . . . . 75.530000000000001 109.922 173.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.53 93.19 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.148 -0.549 . . . . 64.439999999999998 112.492 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.05 -49.34 74.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.921 0.488 . . . . 71.430000000000007 111.164 174.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.512 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.5 t -68.89 -35.96 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 116.351 -0.386 . . . . 61.219999999999999 111.281 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 46.0 mt-10 -57.5 -47.54 81.65 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.088 0.47 . . . . 54.439999999999998 111.154 176.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -60.04 -48.96 79.53 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.077 -0.511 . . . . 75.439999999999998 111.728 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -83.94 -3.63 58.1 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.157 0.428 . . . . 74.219999999999999 112.157 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.4 p80 44.59 86.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.92 1.082 . . . . 72.140000000000001 113.92 175.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.536 HG21 ' OG1' ' A' ' 43' ' ' THR . 81.8 t . . . . . 0 N--CA 1.472 0.628 0 CA-C-O 121.219 0.533 . . . . 74.109999999999999 110.691 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 113.194 0.813 . . . . 62.210000000000001 113.194 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -49.82 -47.57 51.33 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.334 -0.848 . . . . 74.310000000000002 111.61 175.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.456 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.3 tp -69.54 -36.54 76.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.815 -0.63 . . . . 74.340000000000003 111.413 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -68.12 -44.56 75.85 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.236 -0.438 . . . . 73.219999999999999 111.297 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.608 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 24.8 mmm180 -71.94 -32.77 67.66 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.224 0.453 . . . . 63.32 112.224 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -64.16 -51.85 61.83 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.146 0.498 . . . . 73.450000000000003 111.07 174.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 p -61.68 -54.51 41.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.093 -0.503 . . . . 73.409999999999997 111.673 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.519 HD23 HH11 ' A' ' 7' ' ' ARG . 50.6 tp -54.35 -37.96 65.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.444 -0.344 . . . . 64.420000000000002 111.832 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.608 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 1.9 tm-20 -60.28 -53.43 57.79 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.263 0.554 . . . . 73.209999999999994 111.273 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.449 HD13 ' HB3' ' A' ' 40' ' ' ALA . 65.0 mt -63.5 -47.76 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.811 -0.631 . . . . 75.519999999999996 111.342 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.6 mt -61.64 -51.42 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.04 -0.527 . . . . 75.5 111.623 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -52.13 -50.05 62.47 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.05 0.452 . . . . 52.32 111.733 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.565 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 66.7 mtt-85 -62.78 -42.02 99.51 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.859 -0.337 . . . . 70.230000000000004 111.657 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -57.6 -44.08 85.16 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.38 . . . . 73.549999999999997 111.613 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.2 mp -56.84 -44.38 82.04 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.965 0.412 . . . . 72.219999999999999 110.571 174.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -66.52 -32.72 74.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.319 -0.4 . . . . 74.120000000000005 111.996 175.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 8.6 mm-40 -62.35 -41.99 99.04 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.354 0.597 . . . . 74.230000000000004 110.645 177.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -78.46 -30.67 47.53 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.636 -0.711 . . . . 73.5 112.207 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.32 -38.69 71.7 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.937 0.398 . . . . 74.430000000000007 111.739 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 63.6 p -87.05 -36.21 18.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.766 0.317 . . . . 64.310000000000002 111.715 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.638 0 C-N-CA 121.06 -0.591 . . . . 71.140000000000001 111.966 -173.853 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.938 0 N-CA-C 113.953 0.341 . . . . 73.209999999999994 113.953 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -51.09 -42.55 60.68 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.62 0.6 . . . . 74.140000000000001 112.62 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.5 m -54.86 -36.89 65.56 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.257 0.465 . . . . 64.25 112.257 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.3 p -69.77 -38.82 76.87 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.789 0.328 . . . . 74.430000000000007 110.81 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -61.62 -55.08 34.55 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.895 0.378 . . . . 73.420000000000002 111.365 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 20.6 mtpp -55.09 -45.18 75.41 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.001 -0.545 . . . . 61.409999999999997 110.875 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB3' HD13 ' A' ' 12' ' ' ILE . . . -60.48 -44.59 95.76 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.312 -0.404 . . . . 74.319999999999993 111.547 176.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.2 -54.46 40.63 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.336 0.495 . . . . 71.420000000000002 112.336 -177.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.47 -22.37 63.64 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.995 -0.441 . . . . 63.210000000000001 111.864 -177.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.54 HG23 HG21 ' A' ' 152' ' ' VAL . 61.3 m -73.5 -40.44 64.07 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 122.233 -0.292 . . . . 74.230000000000004 110.526 171.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 40' ' ' ALA . 42.3 mt -55.37 -42.34 73.79 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.058 0.392 . . . . 51.210000000000001 112.058 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.49 ' NH2' ' HB3' ' A' ' 19' ' ' GLU . 1.1 ptp85 -74.16 -36.05 64.06 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.007 -0.433 . . . . 74.230000000000004 111.865 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -63.41 -44.62 94.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.777 0.322 . . . . 73.329999999999998 111.664 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 51' ' ' VAL . 25.6 m -87.85 -33.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.813 0.339 . . . . 64.450000000000003 111.699 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.97 -29.97 72.35 Favored Glycine 0 CA--C 1.523 0.587 0 CA-C-N 116.308 -0.406 . . . . 63.109999999999999 113.265 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 12.3 t70 -51.19 -58.02 7.25 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.955 0.407 . . . . 74.129999999999995 110.968 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.02 -45.37 95.72 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.052 -0.594 . . . . 73.230000000000004 113.038 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 47' ' ' VAL . 95.0 t -56.8 -44.86 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 122.493 -0.416 . . . . 72.109999999999999 111.742 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 48.7 mt-30 -64.73 -38.65 91.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.855 0.317 . . . . 74.519999999999996 111.855 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 79.6 mtt-85 -61.67 -37.93 85.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.114 -0.366 . . . . 72.409999999999997 111.756 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -77.15 -46.0 24.88 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.006 0.431 . . . . 74.239999999999995 111.48 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -76.78 -21.21 55.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.033 0.753 . . . . 75.319999999999993 113.033 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -50.4 -55.01 17.62 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 112.265 0.469 . . . . 74.109999999999999 112.265 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -57.34 -27.69 62.46 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 120.867 0.365 . . . . 75.150000000000006 111.85 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.54 -47.15 13.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.454 -0.339 . . . . 72.25 111.724 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.92 -30.97 70.52 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.015 0.376 . . . . 74.219999999999999 112.015 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -52.21 -36.84 53.25 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.835 0.35 . . . . 75.109999999999999 111.195 174.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.68 -29.56 64.4 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.082 -0.508 . . . . 41.299999999999997 113.167 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.467 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 63.2 mtm -90.62 -43.88 9.89 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 122.412 -0.463 . . . . 75.549999999999997 111.658 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HG22 ' A' ' 105' ' ' VAL . 8.2 mp -58.87 -32.98 69.97 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.348 0.499 . . . . 75.030000000000001 112.348 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -60.96 -12.61 11.89 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.645 0.609 . . . . 74.109999999999999 112.645 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.21 5.98 9.15 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.522 0.564 . . . . 72.109999999999999 112.522 179.089 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 62' ' ' MET . 79.3 mt -88.73 -83.47 0.22 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.319 0.489 . . . . 51.450000000000003 112.319 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 49.56 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.488 0.661 . . . . 63.340000000000003 112.529 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -82.37 120.4 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.692 -0.686 . . . . 52.200000000000003 111.239 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -104.2 -14.39 15.86 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.234 0.457 . . . . 72.219999999999999 112.234 178.718 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.449 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -164.93 178.72 6.92 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.308 0.575 . . . . 74.409999999999997 112.282 173.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -48.8 -40.48 29.29 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.288 0.847 . . . . 73.120000000000005 113.288 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -58.31 -35.41 71.8 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 111.769 0.285 . . . . 74.200000000000003 111.769 -175.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.548 ' HB2' HG23 ' A' ' 68' ' ' ILE . 25.3 m-20 -67.8 -41.38 83.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.249 0.547 . . . . 65.129999999999995 110.627 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 87.8 t -56.01 -42.95 73.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 115.892 -0.595 . . . . 73.219999999999999 111.019 177.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.04 -31.47 72.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.912 -0.586 . . . . 74.430000000000007 111.525 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 t -64.86 -37.49 87.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.13 0.49 . . . . 74.230000000000004 110.675 176.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.406 ' O ' ' HG2' ' A' ' 81' ' ' MET . 90.3 mt -59.83 -31.94 70.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.231 -0.441 . . . . 73.409999999999997 111.268 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.2 t -57.8 -36.77 72.67 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.109 0.48 . . . . 61.200000000000003 111.173 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -64.3 -40.98 97.04 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.267 -0.424 . . . . 73.129999999999995 110.656 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.01 -43.89 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 120.947 0.403 . . . . 71.409999999999997 110.527 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.478 ' HB2' HG21 ' A' ' 128' ' ' VAL . 20.0 mmt -55.49 -38.67 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.201 0.524 . . . . 45.039999999999999 111.233 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 74.6 mt -61.06 -41.56 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.024 -0.535 . . . . 74.409999999999997 111.18 175.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -66.05 -28.55 68.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.511 -0.313 . . . . 74.040000000000006 111.533 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 86.8 t -61.65 -35.65 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 111.777 0.288 . . . . 71.219999999999999 111.777 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.579 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 20.7 m-85 . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 112.414 0.524 . . . . 75.230000000000004 112.414 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.477 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.7 m95 . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 112.403 0.52 . . . . 72.200000000000003 112.403 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.73 -25.99 45.46 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.993 -0.622 . . . . 32.539999999999999 112.654 174.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -67.24 -40.22 86.3 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.064 0.459 . . . . 74.049999999999997 110.531 175.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.404 HG13 ' CE3' ' A' ' 92' ' ' TRP . 40.4 mm -63.7 -43.31 98.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 116.074 -0.512 . . . . 75.0 110.062 174.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.8 t -58.85 -42.42 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.894 -0.594 . . . . 70.319999999999993 110.568 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.2 m -58.66 -43.77 89.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.938 0.399 . . . . 75.420000000000002 111.278 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.579 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 32.5 tp -61.46 -55.11 34.83 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.243 0.544 . . . . 63.439999999999998 111.593 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.0 mt -66.84 -40.68 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 116.13 -0.486 . . . . 55.530000000000001 111.717 -176.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 99.9 p -64.32 -44.05 92.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.63 -0.259 . . . . 64.310000000000002 111.172 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -60.8 -42.27 97.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.595 0.236 . . . . 74.230000000000004 110.994 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.66 90.41 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 120.727 -0.749 . . . . 65.239999999999995 112.193 174.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.79 -29.53 69.5 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.105 0.478 . . . . 73.129999999999995 111.597 176.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -68.17 -47.26 68.47 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.256 -0.429 . . . . 74.340000000000003 110.647 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.417 HG22 HD11 ' A' ' 63' ' ' LEU . 53.8 t -64.89 -35.9 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.428 -0.351 . . . . 63.109999999999999 110.43 175.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.87 -43.12 69.31 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.176 -0.466 . . . . 71.010000000000005 111.453 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.429 ' NZ ' ' OE1' ' A' ' 52' ' ' GLN . 52.7 mttp -57.09 -45.92 82.97 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.265 0.555 . . . . 72.5 110.721 174.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' HIS . . . . . 0.402 ' O ' HG12 ' A' ' 112' ' ' ILE . 78.4 t60 -64.04 -33.63 76.17 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.938 -0.574 . . . . 72.409999999999997 111.307 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.34 -49.92 67.55 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.567 -0.288 . . . . 63.0 111.108 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -58.08 -38.42 76.37 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.981 0.419 . . . . 72.329999999999998 110.796 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.2 m -57.54 -35.04 69.78 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.055 -0.52 . . . . 71.439999999999998 111.531 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.9 pt -106.32 31.86 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 120.96 0.41 . . . . 71.549999999999997 111.149 176.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.8 p30 48.94 21.73 0.49 Allowed 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.959 1.096 . . . . 75.239999999999995 113.959 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -90.62 35.88 0.89 Allowed 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.998 -0.439 . . . . 63.210000000000001 111.371 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -44.91 69.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.9 0.333 . . . . 71.25 111.9 -177.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.4 m -57.28 -27.89 62.52 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.075 0.398 . . . . 73.120000000000005 112.075 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.6 m -65.41 -25.82 67.71 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.882 0.373 . . . . 71.109999999999999 111.835 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -53.95 -40.76 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.628 0.603 . . . . 75.409999999999997 112.628 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.57 -52.56 26.48 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.379 0.511 . . . . 73.310000000000002 112.379 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -59.15 -24.97 76.27 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 121.704 1.602 . . . . 53.520000000000003 112.308 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.58 -46.64 68.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.69 -0.485 . . . . 70.040000000000006 109.69 173.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.6 -39.21 79.75 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.291 -0.413 . . . . 72.510000000000005 111.174 174.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -57.33 -44.92 84.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.38 -0.373 . . . . 74.439999999999998 110.706 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 58.8 m -62.37 -45.13 94.56 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.373 -0.376 . . . . 73.239999999999995 111.572 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.432 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.9 mm -54.11 -53.35 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-O 121.44 0.638 . . . . 63.229999999999997 110.836 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' THR . . . . . 0.408 HG21 ' HB2' ' A' ' 10' ' ' LEU . 41.1 m -67.4 -36.39 81.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.521 -0.763 . . . . 61.340000000000003 111.704 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.7 t70 -59.93 -51.45 69.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.801 0.334 . . . . 43.299999999999997 110.598 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 81' ' ' MET . 57.8 t -64.95 -41.87 93.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.049 0.452 . . . . 73.450000000000003 111.122 177.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.511 ' HG ' HD11 ' A' ' 137' ' ' LEU . 52.3 tp -54.41 -53.14 58.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.067 -0.515 . . . . 62.539999999999999 111.462 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.506 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 94.9 t -73.52 -33.1 38.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.187 -0.46 . . . . 74.349999999999994 111.415 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 24.9 tpt180 -48.58 -46.71 39.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.842 0.457 . . . . 74.120000000000005 111.917 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -114.13 -28.56 7.27 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.739 1.014 . . . . 64.340000000000003 113.739 -175.807 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.594 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.5 mptp? -109.5 20.46 18.16 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.409 0.892 . . . . 64.129999999999995 113.409 -177.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 18.7 ttt180 -52.8 -53.91 41.6 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.261 0.467 . . . . 70.329999999999998 112.261 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -68.27 -40.0 82.01 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 111.866 0.321 . . . . 72.030000000000001 111.866 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -60.54 -41.39 94.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.631 0.253 . . . . 73.519999999999996 111.601 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.0 mt -54.84 -55.5 29.68 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.554 -0.294 . . . . 72.099999999999994 111.756 178.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -68.85 -41.12 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 112.218 0.451 . . . . 71.349999999999994 112.218 -178.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 66.5 mmtt -64.4 -39.36 93.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.52 0.563 . . . . 63.43 112.52 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -98.26 8.31 45.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.939 0.4 . . . . 74.519999999999996 111.411 178.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 45.0 mtt180 60.41 22.73 12.3 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.012 -0.54 . . . . 70.349999999999994 112.184 178.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLY . . . . . 0.477 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 20.82 -82.23 0.0 OUTLIER Glycine 0 C--N 1.34 0.8 0 N-CA-C 116.177 1.231 . . . . 72.200000000000003 116.177 176.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.425 ' O ' HG23 ' A' ' 147' ' ' VAL . 37.4 m95 -74.87 -41.8 59.12 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.815 0.302 . . . . 71.430000000000007 111.815 -172.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 9.8 m-20 -62.66 -46.21 89.27 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.468 . . . . 73.219999999999999 110.08 174.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.99 -31.1 77.07 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.969 -0.559 . . . . 73.519999999999996 112.537 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -59.55 -51.74 68.56 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.099 0.559 . . . . 74.019999999999996 110.976 176.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.6 t -59.65 -39.24 79.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 115.813 -0.631 . . . . 74.299999999999997 111.514 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -73.49 -35.66 65.69 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.238 0.459 . . . . 73.120000000000005 112.238 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -62.86 -49.04 76.45 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.925 0.393 . . . . 65.450000000000003 111.473 -177.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -82.95 -16.15 48.48 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.452 -0.34 . . . . 73.010000000000005 111.237 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 83.1 t60 61.33 78.76 0.27 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.493 0.664 . . . . 72.430000000000007 112.017 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.54 HG21 HG23 ' A' ' 43' ' ' THR . 69.3 t . . . . . 0 N--CA 1.47 0.528 0 CA-C-N 115.888 -0.596 . . . . 73.349999999999994 111.737 -178.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 1' ' ' MET . 26.5 ttt . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 121.06 0.457 . . . . 61.450000000000003 111.044 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -114.11 177.04 4.78 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.499 0.666 . . . . 75.530000000000001 112.242 -174.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -103.78 163.51 12.29 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.503 -0.771 . . . . 71.140000000000001 110.394 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -57.28 -45.83 83.7 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.3 0.571 . . . . 63.420000000000002 110.843 175.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 69.5 tp -59.84 -38.88 83.32 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 115.716 -0.675 . . . . 71.420000000000002 111.089 175.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.25 -44.55 91.46 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.112 -0.494 . . . . 63.119999999999997 110.941 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 12.5 mmm180 -63.49 -43.62 96.73 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.004 0.372 . . . . 74.329999999999998 112.004 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.43 ' O ' HG13 ' A' ' 12' ' ' ILE . 50.5 tt0 -60.62 -52.36 65.48 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.906 0.384 . . . . 75.319999999999993 111.35 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.7 p -61.6 -44.3 97.26 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.316 -0.402 . . . . 72.409999999999997 111.2 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.0 tp -54.83 -44.89 74.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.082 -0.508 . . . . 73.439999999999998 111.62 176.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.486 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 9.9 tp10 -61.95 -49.85 74.48 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.797 0.332 . . . . 74.5 111.166 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 8' ' ' GLN . 66.6 mt -54.84 -52.68 40.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 121.228 0.537 . . . . 74.430000000000007 111.106 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 99' ' ' ILE . 81.5 mt -64.78 -41.42 92.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 115.723 -0.671 . . . . 74.409999999999997 111.392 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 48.0 t -56.49 -46.29 80.56 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 116.339 -0.391 . . . . 63.420000000000002 111.418 178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.561 ' NH1' ' SD ' ' A' ' 30' ' ' MET . 62.5 mtp180 -61.89 -53.89 49.52 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.455 -0.339 . . . . 75.120000000000005 111.159 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 36.6 t80 -53.65 -42.02 67.41 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 120.821 0.343 . . . . 75.439999999999998 111.859 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.486 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.5 mp -65.69 -42.53 91.13 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.973 0.36 . . . . 71.120000000000005 111.973 177.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -66.84 -40.16 87.84 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 122.2 -0.312 . . . . 71.310000000000002 111.594 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 45.6 mt-10 -61.73 -50.61 71.71 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.108 0.48 . . . . 51.340000000000003 111.026 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.431 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 27.3 mm-40 -59.66 -40.01 86.33 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.206 -0.452 . . . . 64.120000000000005 111.714 176.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -64.62 -42.55 95.43 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.035 0.445 . . . . 74.019999999999996 111.847 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.464 HG22 ' HE2' ' A' ' 110' ' ' LYS . 69.4 p -87.49 -7.25 57.84 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.253 -0.43 . . . . 71.140000000000001 112.039 -176.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.13 25.31 73.44 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 121.193 -0.527 . . . . 72.430000000000007 113.379 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -152.58 174.78 13.52 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 122.514 0.326 . . . . 62.439999999999998 110.775 -177.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -90.24 148.17 23.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.008 0.433 . . . . 73.439999999999998 111.585 179.189 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.83 165.73 13.11 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 116.201 -0.454 . . . . 62.140000000000001 111.833 -176.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -108.93 -17.21 13.98 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 113.57 0.952 . . . . 73.340000000000003 113.57 -173.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.413 ' HB3' ' HE2' ' A' ' 28' ' ' LYS . 51.6 mtpt -55.38 154.47 11.68 Favored Pre-proline 0 N--CA 1.478 0.964 0 N-CA-C 112.808 0.67 . . . . 61.310000000000002 112.808 -176.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -70.63 175.59 8.6 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 122.629 2.219 . . . . 42.229999999999997 111.722 169.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.561 ' SD ' ' NH1' ' A' ' 15' ' ' ARG . 75.9 mmm -92.51 146.03 23.99 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.214 0.53 . . . . 73.340000000000003 112.038 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -72.98 125.87 10.02 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 114.547 0.579 . . . . 74.530000000000001 114.547 -175.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.2 tpt180 60.98 -80.43 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.029 0.751 . . . . 65.349999999999994 113.029 172.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 74.8 m -82.12 108.27 15.46 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.66 0.267 . . . . 32.219999999999999 111.401 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.36 -57.4 18.73 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 114.28 0.472 . . . . 71.219999999999999 114.28 -176.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.04 -49.95 14.19 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 122.615 -0.344 . . . . 72.209999999999994 111.855 -177.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 87.8 m -55.15 -48.27 73.95 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.152 0.427 . . . . 65.319999999999993 112.152 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.515 ' HB2' ' HB3' ' A' ' 30' ' ' MET . 61.2 m -68.01 -34.67 76.95 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 120.701 0.286 . . . . 73.200000000000003 111.503 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.445 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.1 OUTLIER -63.58 -54.92 28.45 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.733 0.301 . . . . 61.340000000000003 111.449 176.314 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 18.5 ptmt -63.39 -36.85 85.1 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.844 0.355 . . . . 72.329999999999998 111.144 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.464 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -62.99 -46.79 86.04 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.656 0.265 . . . . 63.229999999999997 111.424 176.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.3 tp -61.06 -50.65 72.43 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 112.255 0.465 . . . . 74.519999999999996 112.255 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 9.8 pt-20 -64.8 -35.89 82.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 122.136 -0.353 . . . . 65.25 111.675 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.591 ' O ' HG22 ' A' ' 47' ' ' VAL . 53.6 m -65.96 -47.32 75.02 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.713 0.292 . . . . 72.140000000000001 110.695 174.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.3 mt -53.95 -49.43 68.73 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 112.229 0.455 . . . . 72.420000000000002 112.229 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.458 HH11 ' HD2' ' A' ' 45' ' ' ARG . 10.7 ptm180 -66.43 -41.62 88.92 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.116 0.413 . . . . 65.010000000000005 112.116 -176.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -70.32 -42.99 71.23 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 112.152 0.427 . . . . 73.230000000000004 112.152 -176.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.591 HG22 ' O ' ' A' ' 43' ' ' THR . 25.4 m -82.78 -33.48 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 122.035 -0.416 . . . . 74.329999999999998 111.427 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.408 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -62.11 -40.8 99.42 Favored Glycine 0 C--N 1.335 0.504 0 C-N-CA 121.453 -0.403 . . . . 63.310000000000002 112.675 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 17.4 t70 -55.82 -47.69 76.75 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 120.971 0.415 . . . . 53.329999999999998 110.921 174.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.05 -44.21 96.44 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.972 -0.632 . . . . 75.209999999999994 112.63 177.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.5 t -57.89 -44.36 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 CA-C-O 120.742 0.306 . . . . 74.310000000000002 111.063 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 76.8 mt-30 -60.33 -42.65 96.09 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.598 -0.273 . . . . 65.510000000000005 111.373 176.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.1 mmm180 -55.2 -52.66 62.63 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 111.975 0.361 . . . . 74.420000000000002 111.975 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -75.33 -33.21 61.11 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.16 0.43 . . . . 71.219999999999999 112.16 -177.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -90.91 -17.62 26.13 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.765 1.024 . . . . 74.129999999999995 113.765 -175.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -48.72 -50.25 34.39 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 118.163 0.438 . . . . 74.340000000000003 112.163 -174.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.2 t -55.92 -31.09 62.59 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.046 0.388 . . . . 71.319999999999993 112.046 177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.63 -48.61 11.52 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.38 -0.373 . . . . 52.25 111.692 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -58.55 -47.12 85.3 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.487 -0.324 . . . . 72.439999999999998 111.703 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -52.38 -30.4 28.81 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.877 0.37 . . . . 75.340000000000003 111.758 178.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.16 -39.99 95.16 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 121.285 -0.483 . . . . 51.219999999999999 113.017 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.0 mtm -90.6 -34.71 15.37 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.269 0.557 . . . . 71.420000000000002 110.575 178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.4 tp -58.56 -36.87 74.6 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.955 -0.566 . . . . 71.120000000000005 111.596 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -60.11 -39.43 86.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 116.222 -0.445 . . . . 71.430000000000007 111.849 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.55 -9.78 43.03 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 111.814 0.301 . . . . 75.430000000000007 111.814 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 93.1 mt -82.2 -76.05 0.28 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.656 0.265 . . . . 75.349999999999994 110.61 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.0 t70 47.21 91.89 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.527 0.731 . . . . 74.510000000000005 112.321 -178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -76.68 110.12 11.79 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.243 0.545 . . . . 70.310000000000002 112.019 -175.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.414 ' HD2' ' ND2' ' A' ' 70' ' ' ASN . 0.6 OUTLIER -102.16 -6.92 22.68 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.037 -0.528 . . . . 75.140000000000001 112.094 178.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.414 ' ND2' ' HD2' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.12 169.73 15.82 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.748 0.309 . . . . 73.040000000000006 111.521 173.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -54.31 -32.09 55.65 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.546 0.573 . . . . 63.219999999999999 112.546 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.35 -35.14 67.3 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.869 0.366 . . . . 73.040000000000006 111.729 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.3 m-20 -68.92 -35.52 76.92 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 121.02 0.438 . . . . 70.019999999999996 110.454 177.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 66.7 t -62.84 -41.1 91.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.218 0.532 . . . . 54.200000000000003 110.519 175.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -59.07 -32.16 69.53 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.034 -0.53 . . . . 64.109999999999999 110.856 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.0 m -72.13 -40.26 68.23 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.144 -0.48 . . . . 64.099999999999994 110.801 174.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.484 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.1 mt -56.49 -33.68 66.21 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 116.558 -0.292 . . . . 74.099999999999994 111.007 176.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.432 ' O ' HG13 ' A' ' 82' ' ' ILE . 28.8 t -51.75 -42.18 62.14 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.299 -0.41 . . . . 74.530000000000001 111.494 178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.93 -43.04 99.67 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.896 0.379 . . . . 72.5 111.063 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.47 ' O ' HG23 ' A' ' 84' ' ' VAL . 79.8 t -63.52 -44.19 98.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-O 120.948 0.404 . . . . 65.25 110.745 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.484 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -55.73 -39.23 70.84 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.975 -0.557 . . . . 75.219999999999999 111.625 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 78' ' ' SER . 76.5 mt -62.11 -44.36 98.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-O 121.175 0.512 . . . . 71.150000000000006 111.165 175.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -65.0 -27.9 69.14 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.395 -0.366 . . . . 60.149999999999999 111.955 179.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 80' ' ' VAL . 66.8 t -58.66 -20.99 17.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.807 0.337 . . . . 61.119999999999997 111.672 176.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 37.7 m-85 -106.43 -4.34 19.99 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.352 0.501 . . . . 74.030000000000001 112.352 177.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.2 t -70.49 5.44 1.81 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 112.791 0.663 . . . . 60.310000000000002 112.791 -174.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -65.74 -21.49 66.52 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.273 0.472 . . . . 63.329999999999998 112.273 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 88.43 -44.29 3.17 Favored Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.077 -0.582 . . . . 75.450000000000003 113.328 -178.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.408 ' O ' ' NH2' ' A' ' 94' ' ' ARG . 34.1 m -62.85 -177.54 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.448 0.536 . . . . 72.140000000000001 112.448 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 74.0 p -87.0 -78.99 0.28 Allowed 'General case' 0 N--CA 1.472 0.629 0 O-C-N 122.115 -0.366 . . . . 65.219999999999999 111.17 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 45.41 89.58 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.728 1.01 . . . . 74.209999999999994 113.728 176.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.472 ' CE3' HG13 ' A' ' 95' ' ' ILE . 96.8 m95 -60.28 -20.38 58.88 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.837 0.351 . . . . 72.329999999999998 111.234 173.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.03 -28.5 61.11 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 121.244 -0.503 . . . . 72.019999999999996 112.893 176.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.408 ' NH2' ' O ' ' A' ' 89' ' ' VAL . 64.3 mtm180 -70.17 -34.53 73.1 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.547 -0.384 . . . . 72.319999999999993 111.173 176.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.472 HG13 ' CE3' ' A' ' 92' ' ' TRP . 29.0 mm -58.13 -45.98 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-O 121.601 0.715 . . . . 74.549999999999997 109.437 172.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 57.5 t -60.76 -44.72 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 115.248 -0.887 . . . . 64.549999999999997 111.085 174.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.5 m -61.43 -35.71 78.32 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.292 -0.413 . . . . 62.329999999999998 111.344 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.502 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 22.8 tp -62.77 -55.31 27.68 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.34 0.59 . . . . 72.140000000000001 110.952 176.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 56.3 mt -67.11 -35.24 73.85 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.862 -0.608 . . . . 44.210000000000001 111.377 -178.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 44.0 t -65.52 -47.08 77.17 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.004 -0.544 . . . . 53.25 111.19 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.449 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.3 t80 -62.99 -39.82 95.92 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.748 0.308 . . . . 63.240000000000002 110.593 176.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.7 -46.13 89.73 Favored Glycine 0 CA--C 1.525 0.683 0 C-N-CA 120.856 -0.688 . . . . 65.420000000000002 112.274 175.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.878 0.37 . . . . 74.310000000000002 111.547 176.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -63.13 -39.34 94.39 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.978 0.418 . . . . 75.439999999999998 111.017 178.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 101' ' ' PHE . 40.6 t -75.09 -38.97 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 120.941 0.4 . . . . 70.340000000000003 110.64 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.03 -45.76 82.87 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.42 0.526 . . . . 75.109999999999999 112.42 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 18.3 ptpt -62.46 -34.89 77.71 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.76 0.314 . . . . 63.399999999999999 111.006 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.425 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -65.72 -37.69 87.11 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.853 0.358 . . . . 71.040000000000006 110.505 173.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.533 HD21 ' HB ' ' A' ' 68' ' ' ILE . 87.6 mt -61.78 -50.28 72.97 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.367 -0.379 . . . . 75.230000000000004 111.609 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 66.4 tttp -63.02 -35.64 80.91 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.994 -0.441 . . . . 74.219999999999999 110.79 177.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 85.0 m -56.19 -41.67 75.91 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.928 0.394 . . . . 74.5 110.846 175.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.5 pt -97.97 20.4 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 N-CA-C 112.08 0.4 . . . . 74.329999999999998 112.08 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 71.78 3.45 4.67 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.561 0.948 . . . . 72.519999999999996 113.561 174.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -84.82 45.55 1.17 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.601 0.593 . . . . 61.240000000000002 112.601 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -62.58 -34.25 76.6 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.117 0.414 . . . . 74.219999999999999 112.117 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.4 m -58.88 -26.52 64.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.821 0.343 . . . . 73.200000000000003 111.49 177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -77.83 -27.52 49.96 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 116.551 -0.295 . . . . 72.400000000000006 111.714 178.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.7 mt -57.68 -46.27 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 N-CA-C 112.622 0.601 . . . . 63.539999999999999 112.622 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -65.84 -52.05 44.11 Favored Pre-proline 0 CA--C 1.55 0.943 0 N-CA-C 112.577 0.584 . . . . 74.200000000000003 112.577 -174.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.15 -27.45 84.91 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.802 1.668 . . . . 74.430000000000007 112.134 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -64.71 -48.0 76.26 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 109.711 -0.477 . . . . 72.219999999999999 109.711 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.486 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.04 -39.97 72.8 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.001 0.429 . . . . 72.319999999999993 111.031 174.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -64.09 -36.89 85.51 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.214 -0.448 . . . . 73.109999999999999 111.061 174.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -64.42 -43.18 95.16 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 120.79 0.329 . . . . 74.340000000000003 111.209 176.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 49.3 mm -56.52 -52.92 47.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.27 0.557 . . . . 71.299999999999997 110.57 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.4 m -64.54 -35.17 80.11 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.76 -0.654 . . . . 65.230000000000004 111.39 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 13.7 t70 -60.33 -52.74 63.98 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.37 -0.377 . . . . 74.200000000000003 111.197 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.472 ' O ' HG22 ' A' ' 132' ' ' THR . 66.5 t -64.27 -42.04 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-O 121.027 0.441 . . . . 62.119999999999997 110.791 177.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.1 tp -54.27 -52.87 60.03 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.866 -0.607 . . . . 74.340000000000003 111.257 177.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 85.0 t -74.85 -23.85 17.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 115.958 -0.564 . . . . 74.319999999999993 111.85 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 48.7 ttm-85 -70.17 -46.79 63.91 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.092 0.404 . . . . 73.530000000000001 112.092 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 133' ' ' LYS . 8.0 t -108.26 -34.99 6.66 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 113.373 0.879 . . . . 75.299999999999997 113.373 -176.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.554 ' HG2' HG23 ' A' ' 132' ' ' THR . 75.5 mmtt -99.39 18.66 17.18 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.938 -0.477 . . . . 75.209999999999994 112.017 -177.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 9.0 tpt180 -46.32 -61.71 1.67 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.101 0.56 . . . . 45.149999999999999 112.481 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -62.48 -41.41 98.76 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 115.927 -0.578 . . . . 73.140000000000001 111.985 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -59.55 -38.31 80.74 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.797 0.332 . . . . 54.140000000000001 111.509 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.7 mt -56.62 -51.15 69.77 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.395 -0.366 . . . . 73.329999999999998 111.919 178.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.7 p -78.16 -43.6 27.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 N-CA-C 112.383 0.512 . . . . 63.409999999999997 112.383 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -61.13 -50.5 72.97 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.216 0.451 . . . . 70.099999999999994 112.216 -176.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -94.08 9.84 36.09 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.014 0.435 . . . . 74.040000000000006 111.057 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 143' ' ' TRP . 48.0 mtm180 58.89 25.58 13.84 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.74 -0.664 . . . . 75.109999999999999 111.745 -179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 24.53 -79.78 0.0 OUTLIER Glycine 0 N--CA 1.471 1.013 0 N-CA-C 115.562 0.985 . . . . 61.240000000000002 115.562 175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 40' ' ' ALA . 31.4 m95 -70.83 -46.08 63.38 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.805 0.336 . . . . 70.340000000000003 111.678 -176.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 11.3 m-20 -61.78 -40.49 95.37 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.2 0.524 . . . . 74.230000000000004 110.218 175.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -70.99 -31.17 67.06 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.847 -0.615 . . . . 62.420000000000002 112.705 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -63.54 -46.37 86.31 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.108 0.563 . . . . 71.329999999999998 111.613 178.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.583 HG13 ' HB ' ' A' ' 152' ' ' VAL . 96.7 t -67.44 -36.26 75.89 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 112.33 0.493 . . . . 53.340000000000003 112.33 -178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.737 ' HA ' ' HB2' ' A' ' 154' ' ' ASP . 12.6 pt-20 -74.01 -38.04 64.21 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 122.204 -0.31 . . . . 71.340000000000003 111.157 176.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -60.96 -48.14 83.2 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.824 0.345 . . . . 73.420000000000002 111.453 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -82.5 -1.59 50.9 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.058 0.392 . . . . 72.5 112.058 176.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.627 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 32.2 t60 56.65 72.48 0.5 Allowed 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.47 0.545 . . . . 73.510000000000005 112.47 175.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.583 ' HB ' HG13 ' A' ' 147' ' ' VAL . 97.6 t -103.16 -68.52 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 O-C-N 122.256 -0.278 . . . . 71.340000000000003 110.866 174.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -95.46 9.23 40.78 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.283 0.563 . . . . 72.019999999999996 110.578 171.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.737 ' HB2' ' HA ' ' A' ' 148' ' ' GLU . 17.6 t70 -81.38 156.88 25.22 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 115.983 -0.553 . . . . 71.140000000000001 111.747 -178.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.539 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -137.19 5.95 2.8 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.089 -0.505 . . . . 52.140000000000001 111.43 178.627 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.486 ' HG3' HD22 ' A' ' 155' ' ' LEU . 41.3 mt-10 -105.58 -62.64 1.33 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.411 -0.359 . . . . 74.439999999999998 111.196 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 161.0 -33.85 0.39 Allowed Glycine 0 CA--C 1.525 0.716 0 C-N-CA 120.955 -0.64 . . . . 62.509999999999998 113.62 -177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 74.83 -39.01 1.1 Allowed Glycine 0 CA--C 1.534 1.25 0 C-N-CA 121.452 -0.404 . . . . 73.239999999999995 114.063 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -75.48 119.68 19.88 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.563 -0.375 . . . . 70.150000000000006 111.889 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 -154.16 57.73 0.71 Allowed 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.29 0.566 . . . . 63.539999999999999 110.842 178.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -67.1 122.15 17.16 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.951 -0.568 . . . . 60.049999999999997 112.441 -176.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -134.77 119.54 18.32 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.275 -0.42 . . . . 73.310000000000002 110.717 175.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -104.83 139.35 39.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.886 0.374 . . . . 53.039999999999999 111.469 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 118.857 -0.592 . . . . 71.129999999999995 111.033 176.777 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.282 0.563 . . . . 52.329999999999998 110.351 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -155.39 154.16 31.55 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.876 -0.602 . . . . 61.509999999999998 111.621 -173.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 m-20 -69.68 148.08 49.74 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 115.912 -0.586 . . . . 73.420000000000002 111.597 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.544 ' HG2' ' HD3' ' A' ' 32' ' ' ARG . 8.7 tp10 -65.21 -30.82 71.75 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.495 0.664 . . . . 63.530000000000001 109.262 171.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 137' ' ' LEU . 57.0 tp -55.37 -43.82 75.48 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.454 -0.794 . . . . 73.109999999999999 110.669 170.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.448 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 58.8 t80 -60.54 -47.51 85.87 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.541 -0.754 . . . . 74.120000000000005 111.314 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -71.36 -31.34 67.22 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.077 0.399 . . . . 72.530000000000001 112.077 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 41.0 tt0 -65.61 -53.34 43.03 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.169 0.509 . . . . 64.340000000000003 110.58 175.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.6 p -61.08 -42.47 98.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.808 -0.633 . . . . 53.219999999999999 110.961 178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 tp -55.33 -47.69 75.29 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.022 -0.536 . . . . 74.329999999999998 112.047 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.94 -41.46 91.29 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 120.798 0.332 . . . . 74.430000000000007 111.082 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' GLN . 81.6 mt -59.04 -54.14 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 121.108 0.48 . . . . 74.25 111.074 176.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.433 ' O ' HD13 ' A' ' 17' ' ' LEU . 80.8 mt -61.76 -44.95 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 CA-C-N 116.02 -0.537 . . . . 74.239999999999995 111.235 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.3 t -54.83 -46.6 74.63 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.772 0.32 . . . . 71.420000000000002 111.365 176.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.549 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 9.9 mtp180 -57.96 -58.02 10.26 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.698 0.285 . . . . 64.010000000000005 110.963 175.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.409 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 59.2 t80 -53.68 -44.72 69.93 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.029 -0.532 . . . . 75.519999999999996 111.991 -174.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.442 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 9.0 mp -59.95 -45.98 90.91 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.539 -0.3 . . . . 74.510000000000005 111.556 177.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.447 ' HG3' HH11 ' A' ' 18' ' ' ARG . 39.5 mmm-85 -65.91 -43.88 86.87 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.777 0.323 . . . . 73.409999999999997 111.399 178.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.549 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 42.1 mt-10 -63.26 -41.95 99.09 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.892 0.377 . . . . 44.149999999999999 111.489 -177.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -71.43 -40.62 70.29 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-O 120.8 0.333 . . . . 73.230000000000004 111.735 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.57 -43.92 97.6 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.963 0.411 . . . . 74.109999999999999 111.723 178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 80.9 p -89.04 -16.16 32.31 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.259 0.466 . . . . 52.299999999999997 112.259 -178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 70.05 27.45 72.97 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 120.957 -0.639 . . . . 72.510000000000005 112.465 -176.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.24 -156.62 0.69 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 122.66 0.384 . . . . 61.310000000000002 111.188 -175.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -107.92 146.01 32.99 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.885 0.374 . . . . 73.109999999999999 111.682 179.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -88.44 153.59 21.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 116.492 -0.322 . . . . 72.040000000000006 111.327 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.7 t -89.14 -16.59 31.08 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 113.506 0.928 . . . . 61.229999999999997 113.506 -173.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -61.78 150.42 82.3 Favored Pre-proline 0 N--CA 1.471 0.614 0 O-C-N 122.169 -0.332 . . . . 65.319999999999993 111.533 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.464 ' O ' ' HB2' ' A' ' 30' ' ' MET . 16.1 Cg_endo -58.23 -77.2 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 122.659 2.239 . . . . 71.219999999999999 113.531 -173.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.561 ' SD ' ' HA ' ' A' ' 38' ' ' ARG . 5.6 tpt 174.63 -30.75 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.964 0.411 . . . . 74.329999999999998 111.563 -177.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 119.74 162.19 11.83 Favored Glycine 0 CA--C 1.525 0.705 0 C-N-CA 121.295 -0.478 . . . . 60.409999999999997 112.702 -178.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.544 ' HD3' ' HG2' ' A' ' 4' ' ' GLU . 56.4 ttt85 -54.6 -46.85 73.87 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.695 0.628 . . . . 73.409999999999997 112.695 -177.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 68.8 m -65.03 -16.86 63.91 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.512 0.56 . . . . 75.340000000000003 112.512 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 59.55 -91.47 0.04 OUTLIER Glycine 0 CA--C 1.528 0.861 0 N-CA-C 114.286 0.475 . . . . 65.219999999999999 114.286 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.578 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -60.43 -50.83 72.03 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.063 0.394 . . . . 55.109999999999999 112.063 -176.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.3 m -58.82 -38.82 79.51 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 120.98 0.419 . . . . 74.310000000000002 111.477 -178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.8 p -73.24 -39.07 65.76 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.535 -0.302 . . . . 53.32 111.505 -179.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.561 ' HA ' ' SD ' ' A' ' 30' ' ' MET . 11.9 ttt180 -59.54 -54.58 44.93 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.808 0.337 . . . . 74.519999999999996 111.265 174.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.578 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 22.5 mtpp -55.33 -41.59 72.65 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.055 -0.521 . . . . 64.299999999999997 110.894 -177.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.57 -48.23 82.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.237 -0.438 . . . . 45.200000000000003 111.465 174.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.04 -53.12 60.03 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.126 0.417 . . . . 73.019999999999996 112.126 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -66.51 -21.37 66.17 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.173 -0.33 . . . . 72.219999999999999 111.829 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.45 ' O ' HG22 ' A' ' 47' ' ' VAL . 97.4 m -77.5 -42.31 36.14 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.807 0.337 . . . . 54.240000000000002 110.265 170.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.25 -40.79 71.35 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 116.375 -0.375 . . . . 72.519999999999996 111.72 176.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.409 ' HA ' ' HE1' ' A' ' 16' ' ' TYR . 5.7 ptm180 -72.65 -37.63 67.92 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.055 -0.403 . . . . 64.209999999999994 111.231 178.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -66.91 -44.89 79.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.993 0.425 . . . . 63.229999999999997 111.68 -178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.503 ' O ' HG23 ' A' ' 51' ' ' VAL . 18.7 m -90.94 -33.65 5.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 120.891 0.377 . . . . 75.209999999999994 111.533 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.25 -47.16 83.23 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 116.076 -0.511 . . . . 71.409999999999997 113.902 -176.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 13.7 t70 -51.71 -53.31 40.67 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 117.472 0.636 . . . . 62.100000000000001 110.621 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.88 -46.48 90.49 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.994 -0.548 . . . . 64.409999999999997 113.112 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.0 t -57.62 -42.21 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 O-C-N 122.786 -0.244 . . . . 71.349999999999994 111.033 177.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.3 mt-30 -59.32 -53.39 58.78 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 116.586 -0.279 . . . . 73.120000000000005 110.982 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 9.0 mmm180 -58.33 -41.24 84.16 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.738 0.304 . . . . 73.099999999999994 111.756 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -71.42 -46.05 61.12 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 121.289 0.566 . . . . 72.129999999999995 111.685 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -80.16 -17.53 52.19 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.858 -0.61 . . . . 74.510000000000005 112.479 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 38.0 tt0 -48.18 -54.82 12.1 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.863 0.69 . . . . 73.439999999999998 112.863 -172.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.97 -31.55 67.0 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.902 0.382 . . . . 73.430000000000007 111.843 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -75.7 -36.24 60.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.842 0.353 . . . . 75.049999999999997 111.542 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -76.06 -31.76 58.96 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.947 0.351 . . . . 72.230000000000004 111.947 178.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -48.35 -39.58 22.56 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-O 120.855 0.36 . . . . 70.310000000000002 111.776 178.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.46 -37.95 61.61 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 116.052 -0.522 . . . . 74.549999999999997 113.761 -179.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.474 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 56.9 mtm -90.45 -38.96 12.92 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.119 -0.636 . . . . 64.129999999999995 110.506 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.562 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.5 tp -54.49 -43.85 72.13 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.871 -0.604 . . . . 65.120000000000005 111.868 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -57.22 -30.18 64.37 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.811 0.671 . . . . 63.229999999999997 112.811 -177.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HG2' ' O ' ' A' ' 62' ' ' MET . 19.0 pttp -101.26 4.82 42.12 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 120.866 0.365 . . . . 50.039999999999999 111.854 -177.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.4 mt -99.94 -69.57 0.76 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 120.704 0.288 . . . . 75.510000000000005 110.868 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 71.7 -48.63 0.68 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.479 0.918 . . . . 72.519999999999996 113.479 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.442 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.6 mp 62.97 98.24 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-O 121.571 0.7 . . . . 74.25 111.476 -174.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -102.15 -9.56 20.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.863 -179.332 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -163.12 177.55 9.01 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.459 0.541 . . . . 62.32 112.459 175.374 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.58 -41.85 54.93 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.847 0.684 . . . . 74.439999999999998 112.847 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -54.78 -39.38 68.33 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.659 0.266 . . . . 63.109999999999999 111.309 -178.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.92 -41.93 95.13 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.197 0.523 . . . . 74.140000000000001 110.836 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 84.8 t -57.59 -48.06 84.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.26 0.552 . . . . 61.439999999999998 110.939 176.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -68.7 -26.24 65.19 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 116.311 -0.404 . . . . 74.150000000000006 111.321 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.0 t -65.73 -39.34 91.04 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.064 0.459 . . . . 52.210000000000001 110.682 172.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 81' ' ' MET . 92.0 mt -59.14 -35.44 73.49 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.266 -0.425 . . . . 75.349999999999994 111.075 175.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.437 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.2 t -52.58 -40.43 62.62 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 120.916 0.388 . . . . 71.450000000000003 111.383 178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.8 mmt85 -53.55 -35.97 61.33 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.287 -0.415 . . . . 72.120000000000005 111.46 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 58.2 t -82.72 -39.13 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-O 121.015 0.436 . . . . 75.120000000000005 111.183 176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.454 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.4 mmt -54.37 -37.49 65.04 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.114 0.483 . . . . 71.409999999999997 111.366 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 78' ' ' SER . 74.7 mt -59.28 -40.03 80.33 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 CA-C-N 116.22 -0.445 . . . . 42.32 111.518 175.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -66.62 -32.02 73.08 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 120.767 0.318 . . . . 74.340000000000003 111.474 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 66.3 t -57.39 -29.42 33.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-O 120.991 0.424 . . . . 74.239999999999995 111.542 177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.463 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 25.2 m-85 -91.58 23.43 3.51 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.727 0.639 . . . . 71.239999999999995 112.727 178.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.5 t -51.96 -33.87 39.68 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 112.026 0.38 . . . . 65.340000000000003 112.026 178.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.436 ' HB3' HG22 ' A' ' 89' ' ' VAL . 1.3 m-20 -72.47 131.68 42.88 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.33 0.586 . . . . 73.299999999999997 112.107 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -103.02 17.88 51.08 Favored Glycine 0 CA--C 1.526 0.72 0 CA-C-N 115.911 -0.586 . . . . 42.439999999999998 111.937 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.436 HG22 ' HB3' ' A' ' 87' ' ' ASP . 28.4 m -105.87 -178.21 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 123.03 0.532 . . . . 43.329999999999998 111.893 -177.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.468 HG22 ' HA ' ' A' ' 164' ' ' HIS . 14.6 t -77.38 20.57 0.29 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 113.078 0.77 . . . . 73.120000000000005 113.078 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 96.6 m-20 -68.57 81.0 0.27 Allowed 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.664 -0.648 . . . . 61.520000000000003 111.411 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.34 -16.47 60.5 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.076 -0.511 . . . . 74.109999999999999 111.411 178.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.86 -24.74 50.66 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 121.078 -0.582 . . . . 71.310000000000002 112.763 173.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -64.46 -39.08 93.13 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 122.641 -0.329 . . . . 74.230000000000004 110.767 174.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 39.9 mm -59.35 -48.68 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 121.336 0.589 . . . . 74.120000000000005 110.118 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.45 -46.88 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 115.541 -0.754 . . . . 61.049999999999997 110.988 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.5 m -59.26 -48.81 80.21 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.328 -0.396 . . . . 73.25 111.655 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.505 ' HG ' HG23 ' A' ' 125' ' ' ILE . 33.0 tp -56.59 -54.53 44.9 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.221 0.534 . . . . 71.120000000000005 111.485 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 53.5 mt -67.74 -32.99 59.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 116.018 -0.537 . . . . 73.219999999999999 111.148 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.2 t -60.48 -51.7 68.35 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 116.257 -0.429 . . . . 75.129999999999995 111.291 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 105' ' ' VAL . 28.4 t80 -64.42 -37.76 88.64 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.604 -0.271 . . . . 75.349999999999994 110.782 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -48.99 78.87 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 120.872 -0.68 . . . . 43.340000000000003 112.572 175.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.442 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.62 -35.99 82.81 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.109 0.481 . . . . 64.439999999999998 111.259 176.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.562 ' CE2' HD22 ' A' ' 63' ' ' LEU . 47.4 t80 -62.46 -44.2 96.98 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 116.045 -0.525 . . . . 64.420000000000002 111.115 178.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 101' ' ' PHE . 55.9 t -66.87 -37.53 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-O 120.824 0.345 . . . . 52.439999999999998 110.471 175.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.66 -38.54 72.34 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.237 -0.438 . . . . 61.340000000000003 111.655 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -59.6 -45.05 93.06 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.104 0.478 . . . . 74.040000000000006 110.734 175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.45 ' O ' HG12 ' A' ' 112' ' ' ILE . 82.4 t60 -64.6 -39.95 94.63 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.212 -0.449 . . . . 71.030000000000001 110.704 176.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.23 -49.26 78.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.358 -0.383 . . . . 71.420000000000002 111.564 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -59.99 -44.13 94.72 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.095 0.474 . . . . 54.240000000000002 110.466 178.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.8 m -56.7 -45.09 82.04 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.113 -0.494 . . . . 75.340000000000003 111.706 178.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 108' ' ' HIS . 35.7 pt -87.15 12.66 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 CA-C-O 120.92 0.391 . . . . 71.230000000000004 111.773 178.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 39.3 m-80 67.99 16.58 9.56 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.041 0.756 . . . . 61.299999999999997 113.041 174.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -92.74 38.86 1.03 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 120.83 0.348 . . . . 73.319999999999993 110.942 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.24 -32.95 67.08 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.083 0.401 . . . . 61.049999999999997 112.083 -176.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.5 p -56.26 -38.34 71.03 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.847 0.356 . . . . 74.549999999999997 111.704 177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.5 m -61.96 -26.74 68.38 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.68 0.622 . . . . 75.430000000000007 112.68 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 18' ' ' ARG . 65.8 mt -54.5 -45.36 70.57 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 112.874 0.694 . . . . 74.319999999999993 112.874 -176.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -66.32 -52.71 35.73 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 112.44 0.533 . . . . 54.229999999999997 112.44 -176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.23 -26.11 81.66 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 121.75 1.633 . . . . 52.219999999999999 112.262 173.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.6 tt -66.16 -44.39 84.22 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 109.635 -0.505 . . . . 75.209999999999994 109.635 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.3 -37.67 75.54 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.219 -0.446 . . . . 70.450000000000003 110.896 173.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.05 -39.3 94.32 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.562 -0.29 . . . . 62.32 111.414 174.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 69.7 m -63.15 -45.71 90.63 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.016 0.436 . . . . 70.040000000000006 110.986 177.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.505 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.6 mm -56.58 -52.78 49.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-O 121.297 0.57 . . . . 62.310000000000002 110.794 175.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 21.6 m -65.91 -34.81 78.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.804 -0.635 . . . . 72.299999999999997 111.974 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 20.3 t70 -63.14 -50.27 71.08 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.458 -0.337 . . . . 71.519999999999996 110.53 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.7 t -63.05 -39.82 86.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-O 121.053 0.454 . . . . 51.200000000000003 111.084 176.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.53 ' HG ' HD11 ' A' ' 137' ' ' LEU . 60.1 tp -53.28 -53.12 55.44 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.185 0.517 . . . . 70.209999999999994 111.338 175.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.514 ' HA ' ' HB3' ' A' ' 134' ' ' ARG . 42.0 t -73.6 -31.15 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.675 0 CA-C-N 116.038 -0.528 . . . . 43.340000000000003 111.756 177.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.7 tpt180 -52.54 -42.42 64.4 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.212 0.605 . . . . 61.409999999999997 112.389 -176.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.697 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.6 t -126.16 -21.67 4.23 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.723 1.009 . . . . 75.439999999999998 113.723 -175.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 132' ' ' THR . 32.5 mmtp -122.67 13.27 10.01 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.293 0.849 . . . . 73.420000000000002 113.293 -173.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 135' ' ' ASP . 0.2 OUTLIER -60.26 -40.46 90.43 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 121.537 0.684 . . . . 73.329999999999998 110.913 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 134' ' ' ARG . 33.0 t70 -59.44 -50.63 73.2 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.146 -0.934 . . . . 53.439999999999998 110.803 177.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -59.05 -36.83 75.71 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.739 0.304 . . . . 64.230000000000004 111.549 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.53 HD11 ' HG ' ' A' ' 129' ' ' LEU . 88.1 mt -57.91 -49.33 77.1 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 116.436 -0.347 . . . . 73.109999999999999 111.791 176.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.8 p -77.6 -31.98 17.95 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 N-CA-C 112.041 0.386 . . . . 55.100000000000001 112.041 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.4 mmtt -64.34 -58.58 6.09 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.08 0.466 . . . . 74.439999999999998 111.813 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -91.73 -1.32 57.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.089 0.403 . . . . 73.510000000000005 112.089 -175.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 51.4 mtt-85 59.84 80.83 0.19 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.248 0.547 . . . . 65.430000000000007 110.242 -172.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -55.31 -50.75 58.34 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.474 -0.784 . . . . 71.109999999999999 114.352 -171.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.44 ' O ' HG23 ' A' ' 147' ' ' VAL . 26.1 m95 -73.84 -36.27 64.89 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 117.014 0.407 . . . . 71.239999999999995 111.903 -175.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -63.22 -51.67 65.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.487 0.661 . . . . 61.43 110.741 174.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -67.07 -31.66 78.44 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.486 -0.779 . . . . 51.109999999999999 113.101 179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -56.89 -45.21 82.71 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 121.118 0.485 . . . . 71.120000000000005 111.288 178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 143' ' ' TRP . 48.2 t -65.61 -46.01 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.704 0 CA-C-N 115.96 -0.564 . . . . 61.539999999999999 112.168 -178.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -27.73 61.24 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 112.101 0.408 . . . . 71.0 112.101 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -57.3 -49.1 77.19 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.215 0.531 . . . . 72.319999999999993 110.953 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -83.66 -0.3 50.09 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.263 -0.426 . . . . 71.430000000000007 111.472 173.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 19.3 t60 60.17 37.73 20.58 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 123.335 0.654 . . . . 73.150000000000006 112.055 175.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.468 HG12 ' HG3' ' A' ' 153' ' ' GLU . 60.0 t -76.23 -69.69 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-O 120.873 0.368 . . . . 71.120000000000005 110.922 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.468 ' HG3' HG12 ' A' ' 152' ' ' VAL . 53.4 mt-10 -125.34 61.86 1.2 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-O 121.085 0.469 . . . . 70.450000000000003 111.284 177.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.38 144.38 53.42 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.245 -0.434 . . . . 65.230000000000004 111.139 175.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.487 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -107.51 -7.65 16.48 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 120.789 0.328 . . . . 64.299999999999997 111.583 179.587 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 62.31 2.72 0.9 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 113.588 0.958 . . . . 71.340000000000003 113.588 173.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . 0.433 ' H ' HD23 ' A' ' 155' ' ' LEU . . . -77.84 66.87 3.02 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 121.164 -0.541 . . . . 74.409999999999997 112.572 175.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 71.46 -151.26 48.01 Favored Glycine 0 CA--C 1.53 0.999 0 C-N-CA 121.399 -0.429 . . . . 71.510000000000005 113.547 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 69.86 -61.7 0.44 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.795 0.838 . . . . 64.109999999999999 113.026 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -44.42 103.86 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.124 1.157 . . . . 71.430000000000007 114.124 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 70.4 m80 -142.19 96.61 2.99 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.351 -0.84 . . . . 71.439999999999998 110.036 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -83.05 71.99 10.11 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.286 0.565 . . . . 64.319999999999993 111.853 -175.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -86.31 113.45 22.31 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.175 -0.466 . . . . 72.219999999999999 110.865 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.468 ' HA ' HG22 ' A' ' 90' ' ' THR . 40.3 t-80 . . . . . 0 C--O 1.253 1.277 0 CA-C-O 118.735 -0.65 . . . . 73.540000000000006 112.354 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 mmt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.963 0.411 . . . . 63.350000000000001 110.217 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.774 ' HG3' ' HD3' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -163.39 166.5 22.8 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.018 0.437 . . . . 75.129999999999995 112.075 -172.514 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 4.0 p30 -121.43 178.38 4.82 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 116.181 -0.463 . . . . 54.399999999999999 111.209 176.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.42 -46.08 91.28 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.385 0.513 . . . . 72.239999999999995 112.385 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.584 HD23 ' HG3' ' A' ' 134' ' ' ARG . 65.0 tp -61.28 -42.74 99.16 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.08 0.467 . . . . 73.450000000000003 110.628 -179.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -56.42 -45.29 80.78 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.764 -0.653 . . . . 72.409999999999997 111.037 174.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.774 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 25.3 mmm180 -66.71 -48.47 69.12 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.127 0.417 . . . . 75.409999999999997 112.127 -177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.416 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.6 tt0 -62.1 -51.4 68.06 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.063 0.459 . . . . 73.340000000000003 110.964 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 86.2 p -57.13 -37.74 72.44 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.04 0.447 . . . . 75.329999999999998 110.627 177.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.567 HD11 ' HG2' ' A' ' 123' ' ' GLU . 44.1 tp -60.09 -46.04 90.93 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.919 -0.582 . . . . 62.439999999999998 111.993 178.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.9 pt-20 -67.09 -40.76 87.01 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 120.452 -0.499 . . . . 71.109999999999999 110.939 -178.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.44 ' N ' ' HG3' ' A' ' 11' ' ' GLU . 66.3 mt -57.21 -53.6 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-O 121.158 0.504 . . . . 72.25 110.964 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.468 HG23 HG23 ' A' ' 99' ' ' ILE . 84.3 mt -66.91 -45.69 86.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-N 115.852 -0.613 . . . . 61.009999999999998 111.502 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 27.7 t -56.52 -53.94 51.66 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.406 -0.361 . . . . 71.439999999999998 111.416 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.643 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 40.3 mtt180 -55.95 -49.75 72.67 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.305 -0.257 . . . . 74.439999999999998 110.305 176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.477 ' CD2' HG22 ' A' ' 99' ' ' ILE . 62.7 t80 -52.54 -44.91 66.09 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.994 0.368 . . . . 71.510000000000005 111.994 -178.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.561 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.8 mp -60.66 -40.83 93.51 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 122.371 -0.205 . . . . 74.430000000000007 111.21 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 31.3 mmm-85 -64.63 -42.41 95.51 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.952 0.406 . . . . 70.129999999999995 110.876 177.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.643 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 4.7 mm-40 -56.66 -49.94 73.55 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.594 0.712 . . . . 64.129999999999995 110.881 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -75.43 -30.8 60.15 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.702 -0.681 . . . . 73.120000000000005 112.463 -176.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -38.14 73.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.021 0.439 . . . . 65.140000000000001 111.637 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 60.3 p -87.69 -36.97 17.1 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 116.233 -0.439 . . . . 73.319999999999993 111.231 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.95 -0.8 59.2 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-N 116.28 -0.418 . . . . 71.0 112.517 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.06 -159.89 0.7 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 122.601 0.361 . . . . 73.239999999999995 111.408 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' HD2' ' NH2' ' A' ' 45' ' ' ARG . 29.0 mtmm -131.43 149.71 52.43 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.064 0.459 . . . . 65.030000000000001 111.734 176.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -77.84 159.39 29.0 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 116.112 -0.494 . . . . 65.450000000000003 110.826 170.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.3 t -134.96 9.18 3.54 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.987 0.422 . . . . 65.209999999999994 111.368 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -83.98 153.69 63.68 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-O 120.712 0.291 . . . . 64.120000000000005 111.538 -178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -50.8 151.18 11.42 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.899 2.4 . . . . 64.450000000000003 113.679 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.561 ' HA ' ' NH2' ' A' ' 15' ' ' ARG . 4.2 tpt -80.01 165.68 22.33 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 116.236 -0.438 . . . . 75.409999999999997 110.628 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.35 -86.42 0.16 Allowed Glycine 0 CA--C 1.526 0.762 0 C-N-CA 121.309 -0.472 . . . . 52.420000000000002 113.092 -178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -104.87 -76.85 0.59 Allowed 'General case' 0 N--CA 1.472 0.646 0 O-C-N 122.314 -0.521 . . . . 63.240000000000002 111.575 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.3 t -75.25 121.68 22.53 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.161 0.505 . . . . 73.030000000000001 110.818 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -86.84 -50.48 3.71 Favored Glycine 0 CA--C 1.523 0.588 0 CA-C-N 115.822 -0.627 . . . . 74.430000000000007 113.487 -175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.582 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -74.84 -52.21 11.97 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.405 0.521 . . . . 52.520000000000003 112.405 -174.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.1 m -59.13 -51.34 70.45 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 120.947 0.403 . . . . 71.400000000000006 111.443 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 49.7 m -60.48 -32.69 71.66 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.337 -0.392 . . . . 70.219999999999999 111.65 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -69.14 -48.64 61.83 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.017 0.436 . . . . 73.109999999999999 110.881 178.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.582 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 26.3 mtpp -56.59 -48.37 77.57 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.427 0.632 . . . . 70.420000000000002 110.667 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.71 77.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.758 -0.655 . . . . 73.420000000000002 111.9 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 58.4 tp -54.8 -52.84 61.38 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.297 0.48 . . . . 70.040000000000006 112.297 -177.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.41 -42.25 98.74 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.671 0.272 . . . . 61.25 111.366 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.494 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -63.95 -35.45 80.74 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.755 -0.202 . . . . 64.019999999999996 111.484 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 41.6 mt -53.91 -52.11 61.59 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 120.625 0.25 . . . . 74.319999999999993 111.673 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.441 ' NH2' ' HD2' ' A' ' 25' ' ' LYS . 15.9 ptt180 -77.24 -29.36 53.99 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.198 -0.314 . . . . 74.420000000000002 111.758 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.41 ' NH1' HG11 ' A' ' 152' ' ' VAL . 42.2 ttm180 -61.54 -44.45 97.02 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.421 -0.354 . . . . 72.030000000000001 111.56 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 43' ' ' THR . 22.3 m -93.78 -33.27 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 121.143 0.497 . . . . 73.019999999999996 111.135 176.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -56.82 -59.48 10.75 Favored Glycine 0 C--O 1.226 -0.348 0 CA-C-N 115.706 -0.679 . . . . 53.329999999999998 113.271 -178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.553 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 24.6 t70 -53.12 -34.01 54.86 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 117.322 0.561 . . . . 53.439999999999998 111.406 -178.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.3 -49.33 75.45 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 121.216 -0.516 . . . . 44.32 112.598 175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.62 -37.07 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 CA-C-O 120.817 0.341 . . . . 72.409999999999997 111.464 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.8 mt-30 -56.92 -52.1 66.49 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.398 -0.365 . . . . 75.299999999999997 111.263 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 34.6 mmm-85 -62.09 -27.95 69.28 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 111.987 0.365 . . . . 64.030000000000001 111.987 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-20 -72.05 -41.95 66.84 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.373 0.606 . . . . 74.120000000000005 110.763 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 38.3 m-70 -85.19 -15.67 42.9 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.499 -0.773 . . . . 52.439999999999998 112.582 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 52' ' ' GLN . 43.3 tt0 -47.32 -44.98 24.07 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.305 0.642 . . . . 74.209999999999994 112.717 -170.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.6 t -55.55 -42.56 74.81 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.952 0.406 . . . . 62.130000000000003 111.737 174.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.86 -48.28 32.25 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.795 0.331 . . . . 51.009999999999998 111.794 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -57.49 -44.11 84.69 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.559 -0.291 . . . . 72.120000000000005 111.749 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -55.01 -39.65 69.33 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.121 0.486 . . . . 75.409999999999997 110.835 174.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -63.77 -28.74 73.07 Favored Glycine 0 CA--C 1.527 0.787 0 CA-C-N 116.055 -0.521 . . . . 55.009999999999998 112.787 176.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 82.7 mtp -79.09 -47.98 15.15 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 121.094 0.473 . . . . 74.209999999999994 110.687 175.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.63 -34.84 73.3 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.294 0.479 . . . . 72.409999999999997 112.294 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 64' ' ' ARG . 12.0 ptt180 -67.79 -16.7 64.24 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 111.968 0.359 . . . . 62.409999999999997 111.968 -178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.81 11.27 22.49 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.087 0.47 . . . . 71.450000000000003 111.161 174.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 83.8 mt -118.9 -73.66 0.64 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 116.026 -0.534 . . . . 63.530000000000001 111.221 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 70.45 -43.86 0.56 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 113.766 1.024 . . . . 73.120000000000005 113.766 -179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.451 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.5 mp 62.83 90.27 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.445 0.64 . . . . 64.150000000000006 111.026 -174.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -12.6 33.13 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.975 -0.557 . . . . 75.420000000000002 111.935 -178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -159.23 175.28 13.61 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.359 0.599 . . . . 73.120000000000005 112.274 176.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.08 -35.26 69.17 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.678 -0.692 . . . . 63.409999999999997 112.71 -177.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -62.58 -29.2 70.42 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.279 0.474 . . . . 75.219999999999999 112.279 -178.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 50.6 m-20 -66.68 -41.45 88.08 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.076 0.465 . . . . 62.549999999999997 110.144 174.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.3 t -57.37 -39.95 71.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.017 -0.538 . . . . 64.230000000000004 110.525 174.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -59.17 -42.05 89.88 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 121.168 0.509 . . . . 63.119999999999997 110.628 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.5 t -67.8 -35.83 79.35 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.028 -0.533 . . . . 72.400000000000006 111.745 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 84.3 mt -55.78 -30.63 61.63 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.658 0.266 . . . . 74.019999999999996 111.523 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 82' ' ' ILE . 22.6 t -52.94 -37.41 60.95 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.009 0.433 . . . . 74.120000000000005 111.131 177.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -59.69 -49.11 79.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.112 0.482 . . . . 70.120000000000005 111.104 177.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -63.28 -41.46 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 115.97 -0.559 . . . . 65.439999999999998 110.996 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.403 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.4 mmt -58.04 -37.78 75.02 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.951 -0.568 . . . . 63.350000000000001 111.464 178.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 78' ' ' SER . 80.1 mt -63.42 -38.12 81.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 CA-C-O 120.845 0.355 . . . . 72.319999999999993 111.045 173.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -62.23 -33.42 74.55 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.669 0.271 . . . . 73.530000000000001 111.613 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.534 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 95.7 t -56.27 -34.64 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-O 120.988 0.423 . . . . 74.209999999999994 111.442 177.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 74.2 m-85 -85.78 10.21 14.3 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.563 0.579 . . . . 72.409999999999997 112.563 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.3 t -68.67 -46.92 67.83 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.958 0.409 . . . . 72.129999999999995 111.494 177.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.656 ' HB2' ' HD2' ' A' ' 94' ' ' ARG . 3.7 m-20 -62.38 116.45 5.08 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.124 -0.489 . . . . 75.099999999999994 111.758 -179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -75.44 61.44 2.76 Favored Glycine 0 CA--C 1.529 0.965 0 C-N-CA 121.477 -0.392 . . . . 74.409999999999997 113.06 178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 59.6 t -74.35 -17.63 16.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 122.653 0.381 . . . . 52.149999999999999 111.982 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 35.1 p 63.58 -62.11 0.15 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.237 1.015 . . . . 71.209999999999994 111.971 -174.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -55.64 159.82 2.79 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.329 0.585 . . . . 71.420000000000002 112.519 176.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -69.24 11.32 0.23 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.182 0.808 . . . . 73.129999999999995 113.182 -175.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.78 -37.76 70.5 Favored Glycine 0 CA--C 1.53 0.975 0 C-N-CA 121.189 -0.529 . . . . 74.040000000000006 113.061 177.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.656 ' HD2' ' HB2' ' A' ' 87' ' ' ASP . 3.7 mmp_? -61.6 -36.78 81.66 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.77 0.319 . . . . 71.230000000000004 111.781 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.4 mm -60.01 -44.89 95.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.121 0.486 . . . . 74.030000000000001 110.723 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -58.41 -49.64 81.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 116.037 -0.529 . . . . 74.219999999999999 111.055 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 50.4 m -57.05 -47.66 80.42 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.796 0.331 . . . . 71.409999999999997 111.49 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.492 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 31.6 tp -58.65 -55.77 30.85 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.193 0.52 . . . . 62.439999999999998 112.068 -178.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.477 HG22 ' CD2' ' A' ' 16' ' ' TYR . 41.4 mt -70.46 -34.82 59.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 116.188 -0.46 . . . . 71.430000000000007 111.587 -174.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.5 m -66.54 -41.9 88.01 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.764 -0.198 . . . . 73.439999999999998 111.38 177.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.437 ' O ' HG23 ' A' ' 105' ' ' VAL . 22.7 t80 -62.16 -43.8 98.02 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.705 0.288 . . . . 63.32 110.691 177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -55.98 -45.57 86.47 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 120.891 -0.671 . . . . 70.129999999999995 112.375 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.549 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.83 -33.78 76.36 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.844 0.354 . . . . 73.209999999999994 111.816 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -65.61 -43.27 90.09 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.96 0.41 . . . . 71.209999999999994 110.54 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 101' ' ' PHE . 48.9 t -65.91 -38.47 82.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-O 120.851 0.358 . . . . 65.120000000000005 110.439 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.63 -41.2 69.76 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.185 -0.462 . . . . 64.209999999999994 111.865 177.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -54.34 -48.91 70.88 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.528 0.68 . . . . 71.319999999999993 110.619 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.471 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.4 t60 -67.05 -39.71 86.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.76 -0.655 . . . . 74.219999999999999 111.533 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 88.5 mt -58.65 -50.14 74.96 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.737 0.303 . . . . 65.409999999999997 111.331 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -59.57 -45.95 90.33 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.084 0.469 . . . . 72.129999999999995 111.035 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 63.2 m -55.68 -40.23 72.02 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.937 -0.574 . . . . 43.140000000000001 112.231 179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.4 pt -96.57 21.2 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 112.507 0.558 . . . . 64.209999999999994 112.507 -177.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 69.16 10.43 7.84 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.832 0.679 . . . . 65.200000000000003 112.832 176.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -92.12 27.45 2.17 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.024 0.44 . . . . 73.219999999999999 110.589 175.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.514 ' HG3' HD12 ' A' ' 118' ' ' ILE . 70.8 tt0 -58.93 -34.86 72.21 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.342 0.497 . . . . 72.150000000000006 112.342 -174.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 40.9 m -56.92 -31.98 65.47 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.927 0.394 . . . . 75.519999999999996 111.195 176.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.2 m -64.74 -26.37 68.33 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.396 0.517 . . . . 72.140000000000001 112.396 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.514 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.0 mt -53.67 -41.22 46.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 112.725 0.639 . . . . 72.540000000000006 112.725 -176.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -70.04 -54.64 9.44 Favored Pre-proline 0 CA--C 1.546 0.791 0 N-CA-C 112.403 0.519 . . . . 74.239999999999995 112.403 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.13 -29.34 86.93 Favored 'Trans proline' 0 C--N 1.359 1.101 0 C-N-CA 121.712 1.608 . . . . 75.129999999999995 112.263 174.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.7 tt -65.01 -46.39 81.55 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.867 -0.42 . . . . 75.040000000000006 109.867 173.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.561 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -56.93 -40.78 77.01 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.206 -0.452 . . . . 74.129999999999995 110.819 173.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.567 ' HG2' HD11 ' A' ' 10' ' ' LEU . 42.1 mt-10 -63.98 -32.87 74.56 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.095 -0.502 . . . . 73.230000000000004 111.162 177.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.0 m -68.01 -38.64 82.84 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.59 0.234 . . . . 72.439999999999998 111.186 173.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.5 mm -58.34 -53.27 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-O 121.227 0.537 . . . . 75.439999999999998 110.405 174.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 61.0 m -64.11 -35.15 79.82 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.838 -0.619 . . . . 64.439999999999998 111.203 176.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 23.3 t70 -59.97 -52.58 64.78 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.536 0.199 . . . . 72.209999999999994 111.536 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 96.3 t -63.65 -45.46 97.42 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 121.14 0.495 . . . . 63.450000000000003 110.651 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.553 ' HG ' HD11 ' A' ' 137' ' ' LEU . 46.4 tp -51.58 -52.13 49.83 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.785 -0.643 . . . . 75.540000000000006 111.079 177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.543 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -69.36 -37.04 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 CA-C-N 115.89 -0.595 . . . . 70.319999999999993 111.836 177.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.4 tpt180 -58.4 -35.89 72.71 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 116.17 -0.468 . . . . 72.030000000000001 112.151 -174.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.409 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.6 t -123.26 -16.74 6.82 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.365 0.876 . . . . 74.430000000000007 113.365 -177.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.409 ' HG2' HG23 ' A' ' 132' ' ' THR . 45.3 mmtm -132.39 16.49 4.48 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.965 1.098 . . . . 72.329999999999998 113.965 -172.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.584 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.7 ttp180 -60.33 -50.8 72.17 Favored 'General case' 0 N--CA 1.478 0.954 0 CA-C-N 118.786 0.721 . . . . 75.150000000000006 111.304 176.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 30.7 t70 -55.64 -44.74 77.43 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 121.061 0.458 . . . . 75.019999999999996 110.653 177.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -63.34 -36.59 84.19 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 116.366 -0.379 . . . . 72.230000000000004 111.867 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.553 HD11 ' HG ' ' A' ' 129' ' ' LEU . 61.0 mt -57.0 -50.44 72.71 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.679 0.276 . . . . 72.439999999999998 111.275 174.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 14.8 p -77.8 -32.28 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 N-CA-C 112.546 0.573 . . . . 74.329999999999998 112.546 -177.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 74.6 mmtt -72.36 -51.9 18.5 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.069 -0.395 . . . . 54.350000000000001 111.585 177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -86.1 -9.33 56.89 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.467 -0.333 . . . . 73.409999999999997 111.762 -177.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 81.6 mtt-85 61.61 60.16 1.69 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.403 0.621 . . . . 71.540000000000006 110.124 -177.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -48.06 -49.62 23.62 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 115.1 -0.954 . . . . 53.219999999999999 115.354 -171.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -69.07 -43.19 75.08 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 117.428 0.614 . . . . 74.239999999999995 112.046 -174.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.5 -32.8 73.03 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.212 0.529 . . . . 64.540000000000006 110.83 174.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.52 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -74.3 -30.53 60.51 Favored Glycine 0 CA--C 1.525 0.66 0 CA-C-N 116.002 -0.544 . . . . 71.209999999999994 112.74 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -57.33 -42.94 82.87 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.121 0.486 . . . . 71.420000000000002 111.133 177.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE3' ' A' ' 39' ' ' LYS . 30.8 t -68.03 -42.17 85.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-N 115.926 -0.579 . . . . 74.310000000000002 111.781 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.52 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.9 pt-20 -71.82 -32.1 67.23 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 120.655 0.264 . . . . 73.430000000000007 111.518 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.67 -49.36 78.05 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.853 0.359 . . . . 74.329999999999998 111.523 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -83.58 -1.8 54.64 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.819 0.303 . . . . 75.430000000000007 111.819 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.503 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 37.3 t60 59.66 21.91 10.62 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.741 0.416 . . . . 74.209999999999994 111.915 175.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.532 HG12 ' HG3' ' A' ' 153' ' ' GLU . 94.6 t -56.02 -61.93 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.976 0.417 . . . . 63.109999999999999 112.089 -176.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.532 ' HG3' HG12 ' A' ' 152' ' ' VAL . 52.8 mt-10 -115.94 27.75 9.08 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 121.399 0.619 . . . . 60.130000000000003 110.657 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.503 ' HB3' ' HA ' ' A' ' 151' ' ' HIS . 5.3 t70 -102.96 154.15 19.51 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.55 -0.75 . . . . 73.109999999999999 110.955 177.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.572 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -130.53 5.19 4.71 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.094 0.776 . . . . 75.439999999999998 113.094 -175.776 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -110.21 -41.13 4.5 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 112.442 0.534 . . . . 72.409999999999997 112.442 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 135.12 -12.72 4.4 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.462 -0.399 . . . . 41.409999999999997 112.624 -177.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 75.89 -145.76 32.87 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.262 -0.495 . . . . 54.310000000000002 113.15 -178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -42.7 107.64 0.08 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 121.265 0.555 . . . . 72.099999999999994 112.004 175.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -93.65 -10.01 35.97 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 116.401 -0.363 . . . . 72.230000000000004 111.562 -178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 11.6 p-80 -154.43 121.53 5.63 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 120.961 0.41 . . . . 74.349999999999994 111.649 178.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 8.8 p-80 -76.85 156.97 31.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.396 0.517 . . . . 70.430000000000007 112.396 -177.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -157.8 139.76 14.14 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 72.340000000000003 111.027 175.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.7 p80 . . . . . 0 C--O 1.254 1.337 0 N-CA-C 112.321 0.489 . . . . 61.25 112.321 -178.624 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.617 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.722 0 CA-C-O 121.117 0.484 . . . . 75.519999999999996 110.903 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -129.95 168.77 16.15 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.434 0.531 . . . . 54.310000000000002 112.434 -170.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.16 155.2 39.39 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.349 0.87 . . . . 73.439999999999998 113.349 -174.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.442 ' OE2' ' HD3' ' A' ' 32' ' ' ARG . 40.6 tt0 -56.48 -44.45 80.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.336 -0.847 . . . . 73.430000000000007 110.702 173.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 137' ' ' LEU . 60.0 tp -54.69 -43.71 72.74 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.838 -0.619 . . . . 65.340000000000003 111.782 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -68.31 -50.4 53.72 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 120.813 0.34 . . . . 72.040000000000006 111.365 179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.3 mtm180 -63.55 -37.84 88.83 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.096 0.406 . . . . 71.340000000000003 112.096 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -69.44 -52.25 28.52 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.425 -0.352 . . . . 74.329999999999998 111.189 178.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -59.44 -51.86 68.08 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 120.716 0.293 . . . . 74.530000000000001 111.285 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.3 -45.0 65.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.284 -0.416 . . . . 74.310000000000002 111.689 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.554 ' HG2' ' HD2' ' A' ' 15' ' ' ARG . 28.2 tt0 -62.79 -51.56 66.62 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.72 0.295 . . . . 64.450000000000003 111.228 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' GLN . 72.0 mt -55.24 -48.76 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-O 121.072 0.463 . . . . 63.329999999999998 111.444 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.475 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.9 mt -64.04 -50.27 77.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 116.117 -0.492 . . . . 73.310000000000002 111.571 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 28.7 t -53.62 -54.23 40.57 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.812 0.339 . . . . 64.430000000000007 111.769 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.58 HH12 ' HA ' ' A' ' 30' ' ' MET . 55.0 mtp180 -58.06 -50.29 73.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.299 -0.409 . . . . 75.340000000000003 111.386 -178.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -54.64 -47.45 73.49 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.796 0.331 . . . . 70.340000000000003 111.444 177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.475 HD13 ' O ' ' A' ' 13' ' ' ILE . 8.3 mp -59.11 -45.45 90.87 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 111.781 0.289 . . . . 71.030000000000001 111.781 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.4 mmm180 -62.58 -53.06 60.22 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.652 0.263 . . . . 72.530000000000001 111.217 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 10.1 pt-20 -64.86 -35.02 79.76 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.832 0.349 . . . . 73.340000000000003 111.889 -178.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.553 ' HG2' ' HB1' ' A' ' 103' ' ' ALA . 8.1 tp-100 -69.5 -25.75 64.2 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.959 0.409 . . . . 73.200000000000003 111.121 177.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.71 -31.29 21.09 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.122 0.416 . . . . 71.329999999999998 112.122 177.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' ARG . 66.4 p -87.71 -37.75 16.41 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.191 0.441 . . . . 50.009999999999998 112.191 -178.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 100.93 -6.94 57.04 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 116.216 -0.447 . . . . 65.25 112.379 -173.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -114.64 114.71 26.05 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 122.658 -0.319 . . . . 75.129999999999995 111.317 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.574 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -66.51 141.18 57.97 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.09 0.471 . . . . 74.120000000000005 112.068 -177.348 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -76.8 163.58 26.65 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-O 121.155 0.502 . . . . 74.430000000000007 112.191 -173.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.0 t -148.67 19.96 1.03 Allowed 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.96 0.726 . . . . 75.120000000000005 112.96 -176.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -69.64 162.89 64.22 Favored Pre-proline 0 CA--C 1.545 0.786 0 O-C-N 122.063 -0.398 . . . . 62.130000000000003 111.696 177.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -51.89 133.15 44.83 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.297 1.998 . . . . 72.319999999999993 111.845 171.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.58 ' HA ' HH12 ' A' ' 15' ' ' ARG . 7.7 tpt -84.05 163.92 19.59 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 120.818 0.342 . . . . 74.239999999999995 111.701 -174.122 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -53.2 171.72 0.58 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 116.412 -0.358 . . . . 31.129999999999999 113.591 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.442 ' HD3' ' OE2' ' A' ' 4' ' ' GLU . 50.0 ttt-85 -44.18 -51.69 7.94 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 112.485 0.55 . . . . 75.420000000000002 112.485 -175.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -73.07 117.96 15.44 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.772 0.32 . . . . 64.129999999999995 110.352 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.77 -81.91 0.68 Allowed Glycine 0 CA--C 1.526 0.777 0 C-N-CA 121.256 -0.497 . . . . 53.32 113.701 -175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.71 -50.36 60.67 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.572 0.582 . . . . 55.109999999999999 112.572 -175.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.2 m -55.17 -51.62 65.92 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.125 0.417 . . . . 71.450000000000003 112.125 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 58.6 m -60.61 -42.44 96.81 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 111.921 0.341 . . . . 74.219999999999999 111.921 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -60.79 -42.08 96.86 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.046 0.451 . . . . 73.430000000000007 110.891 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -64.34 -43.64 93.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.892 -0.595 . . . . 70.200000000000003 111.408 177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.51 -55.12 37.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.764 0.316 . . . . 71.010000000000005 111.538 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 62.2 tp -54.7 -41.68 70.57 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.204 0.526 . . . . 75.140000000000001 110.973 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -62.5 -47.14 85.26 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 115.818 -0.628 . . . . 72.510000000000005 111.479 177.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.577 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.2 m -61.87 -41.39 97.79 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.134 -0.484 . . . . 74.409999999999997 111.521 -179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 86.3 mt -53.6 -33.67 55.77 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.181 0.438 . . . . 71.010000000000005 112.181 -179.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.526 ' HD3' ' OE2' ' A' ' 19' ' ' GLU . 42.7 mtm-85 -72.75 -55.29 6.98 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.855 0.317 . . . . 70.349999999999994 111.855 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -63.1 -37.19 86.23 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.819 0.674 . . . . 63.100000000000001 112.819 -176.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.577 HG22 ' O ' ' A' ' 43' ' ' THR . 15.5 m -91.96 -31.18 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 O-C-N 122.052 -0.405 . . . . 70.209999999999994 111.948 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.52 -43.78 85.32 Favored Glycine 0 CA--C 1.525 0.668 0 C-N-CA 121.291 -0.48 . . . . 42.229999999999997 114.061 -175.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -51.7 -53.5 38.52 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 117.0 0.4 . . . . 64.019999999999996 111.977 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.82 -46.74 74.98 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 121.105 -0.569 . . . . 70.430000000000007 112.864 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.6 t -58.46 -49.16 83.15 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-O 120.818 0.342 . . . . 53.240000000000002 111.117 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -57.12 -44.24 83.09 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.365 -0.38 . . . . 72.299999999999997 111.929 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 -68.73 -51.07 45.37 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.331 0.493 . . . . 61.32 112.331 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -61.9 -36.81 82.43 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.412 0.625 . . . . 73.200000000000003 111.385 179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.32 -16.67 57.49 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.501 -0.772 . . . . 74.329999999999998 112.988 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.32 -50.0 22.79 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.911 0.708 . . . . 72.120000000000005 112.911 -171.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.9 t -53.81 -40.43 66.36 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.859 0.361 . . . . 61.130000000000003 111.791 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.57 -41.33 60.71 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 120.724 0.297 . . . . 73.209999999999994 111.547 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -62.69 -47.58 83.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.402 -0.363 . . . . 65.120000000000005 111.535 178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 81.9 mm-40 -53.11 -39.02 63.1 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.131 0.491 . . . . 72.030000000000001 110.993 176.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.53 -29.57 69.84 Favored Glycine 0 CA--C 1.528 0.845 0 CA-C-N 115.945 -0.571 . . . . 63.43 113.063 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 63.5 mtm -89.61 -42.11 11.59 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 122.379 -0.483 . . . . 73.439999999999998 111.596 177.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.7 mp -55.09 -35.51 64.68 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.232 0.456 . . . . 70.209999999999994 112.232 -179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -63.56 -22.05 66.68 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 112.495 0.554 . . . . 74.040000000000006 112.495 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.426 ' HD2' ' HG ' ' A' ' 66' ' ' LEU . 0.0 OUTLIER -108.2 10.58 27.86 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.424 0.631 . . . . 72.519999999999996 111.21 174.42 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.426 ' HG ' ' HD2' ' A' ' 65' ' ' LYS . 91.6 mt -117.18 -76.18 0.57 Allowed 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.775 -0.648 . . . . 62.039999999999999 110.274 175.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.9 t0 71.12 -40.72 0.48 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.287 1.035 . . . . 65.010000000000005 113.426 177.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.559 HD11 HD21 ' A' ' 77' ' ' LEU . 3.0 mp 60.42 94.25 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.975 0.91 . . . . 63.340000000000003 112.541 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.76 -10.1 17.66 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 116.201 -0.454 . . . . 74.340000000000003 111.165 176.631 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.478 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -158.73 169.58 24.07 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 116.39 -0.368 . . . . 72.150000000000006 111.252 175.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -57.52 -32.19 66.8 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.171 0.804 . . . . 73.140000000000001 113.171 -173.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.21 -33.38 58.14 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-O 120.946 0.403 . . . . 74.510000000000005 111.722 177.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 49.9 m-20 -71.46 -39.56 70.87 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.015 0.436 . . . . 70.299999999999997 110.458 176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -58.67 -45.45 90.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-O 121.253 0.549 . . . . 74.150000000000006 110.805 176.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.59 -33.19 73.47 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.195 0.522 . . . . 61.229999999999997 111.077 175.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.6 m -69.21 -29.19 67.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.165 -0.47 . . . . 61.329999999999998 111.327 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.559 HD21 HD11 ' A' ' 68' ' ' ILE . 94.0 mt -61.77 -35.39 77.99 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.78 0.324 . . . . 64.140000000000001 110.813 174.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -55.47 -39.2 70.07 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.064 0.459 . . . . 74.010000000000005 111.013 175.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -62.3 -41.55 98.61 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.238 -0.437 . . . . 73.430000000000007 110.706 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.434 ' O ' HG23 ' A' ' 84' ' ' VAL . 83.7 t -59.35 -43.51 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 120.928 0.394 . . . . 62.240000000000002 110.47 174.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.485 ' HB2' HG21 ' A' ' 128' ' ' VAL . 18.9 mmt -56.74 -43.61 80.89 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.994 -0.548 . . . . 75.099999999999994 111.16 177.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 69.6 mt -59.08 -34.5 53.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-O 121.183 0.516 . . . . 70.510000000000005 110.964 175.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -73.08 -32.24 64.88 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 116.199 -0.455 . . . . 43.100000000000001 111.366 178.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 80' ' ' VAL . 88.0 t -59.45 -38.38 74.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-O 120.903 0.383 . . . . 73.109999999999999 111.924 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.411 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 72.6 m-85 -88.57 32.76 0.77 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.192 0.441 . . . . 65.430000000000007 112.192 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.3 t -65.01 -19.83 66.19 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.988 0.423 . . . . 64.010000000000005 111.354 175.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.13 144.09 50.37 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.027 0.442 . . . . 50.450000000000003 111.641 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -89.78 -19.51 47.53 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 121.035 -0.602 . . . . 25.420000000000002 113.314 -178.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 28.4 m -75.58 143.62 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.244 0.545 . . . . 64.219999999999999 112.365 -178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 35.7 m -88.77 91.68 8.91 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.138 -0.483 . . . . 63.130000000000003 110.532 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -130.49 133.79 46.56 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.247 0.546 . . . . 73.310000000000002 111.808 -178.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.461 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 71.8 m95 -67.46 -17.38 64.67 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.132 -0.485 . . . . 71.129999999999995 112.033 -176.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.34 82.55 Favored Glycine 0 CA--C 1.53 0.979 0 C-N-CA 121.252 -0.499 . . . . 31.129999999999999 112.905 176.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' A' ' 94' ' ' ARG . 25.4 mmt180 -70.91 -32.49 69.44 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.464 -0.433 . . . . 74.219999999999999 111.117 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.413 HG13 ' HE3' ' A' ' 92' ' ' TRP . 46.3 mm -62.21 -46.29 96.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 121.032 0.444 . . . . 72.239999999999995 110.546 174.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 46.6 t -57.41 -48.25 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 116.129 -0.487 . . . . 71.030000000000001 110.869 174.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 85.1 m -56.55 -43.27 79.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.247 -0.433 . . . . 73.430000000000007 111.654 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 33.5 tp -59.3 -55.23 37.51 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.211 0.529 . . . . 72.239999999999995 111.652 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.1 mt -68.84 -34.08 62.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 116.071 -0.513 . . . . 75.329999999999998 111.449 -177.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.5 m -64.91 -45.17 86.99 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.466 -0.333 . . . . 72.519999999999996 111.409 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -62.16 -43.06 99.68 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.77 0.319 . . . . 75.25 110.651 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.55 -46.45 92.03 Favored Glycine 0 CA--C 1.527 0.807 0 C-N-CA 120.872 -0.68 . . . . 14.220000000000001 112.417 175.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.553 ' HB1' ' HG2' ' A' ' 20' ' ' GLN . . . -66.73 -31.95 72.94 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.076 0.465 . . . . 65.349999999999994 111.951 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -66.19 -48.44 70.65 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.833 0.349 . . . . 63.229999999999997 110.571 177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.9 t -65.44 -36.48 77.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.884 0.373 . . . . 74.430000000000007 110.573 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.34 -43.75 67.95 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.065 -0.516 . . . . 74.219999999999999 111.728 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -54.57 -49.54 70.09 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.149 0.5 . . . . 71.099999999999994 110.771 175.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.476 ' O ' HG12 ' A' ' 112' ' ' ILE . 79.1 t60 -60.87 -40.19 92.03 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.037 -0.529 . . . . 74.409999999999997 111.36 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 88.2 mt -62.17 -50.46 71.76 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.715 0.293 . . . . 74.450000000000003 111.658 -179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.473 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.0 tttm -62.89 -33.53 75.49 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.201 0.524 . . . . 75.340000000000003 111.212 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.9 m -64.14 -45.38 88.77 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.196 -0.456 . . . . 72.329999999999998 111.721 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.512 HG13 ' HG2' ' A' ' 114' ' ' GLN . 47.2 pt -90.33 24.64 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 N-CA-C 112.674 0.62 . . . . 74.409999999999997 112.674 -178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 69.28 12.49 8.4 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 112.848 0.685 . . . . 72.049999999999997 112.848 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.512 ' HG2' HG13 ' A' ' 112' ' ' ILE . 13.6 mm100 -99.61 36.99 1.67 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.071 -0.393 . . . . 70.040000000000006 111.633 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.89 -32.81 69.84 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.794 0.331 . . . . 71.200000000000003 111.492 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.442 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 52.4 m -53.79 -41.42 67.22 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.93 0.395 . . . . 61.310000000000002 111.344 174.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.457 ' HB2' HD13 ' A' ' 109' ' ' LEU . 53.1 m -56.9 -27.41 60.68 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.844 0.683 . . . . 74.120000000000005 112.844 -176.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 63.9 mt -57.77 -33.55 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 112.203 0.446 . . . . 43.439999999999998 112.203 -178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -71.79 -54.61 6.15 Favored Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 112.481 0.549 . . . . 72.400000000000006 112.481 -177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.442 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.5 Cg_endo -59.52 -26.38 81.83 Favored 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.518 1.479 . . . . 72.120000000000005 111.799 172.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.434 HD12 HD11 ' A' ' 109' ' ' LEU . 6.5 tt -66.19 -46.13 78.37 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.661 -0.496 . . . . 74.519999999999996 109.661 173.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.14 -44.58 87.9 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.252 -0.431 . . . . 75.109999999999999 110.802 174.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -58.82 -39.48 81.3 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.4 -0.364 . . . . 71.329999999999998 111.176 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -61.67 -41.83 98.09 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.918 0.39 . . . . 62.100000000000001 111.006 176.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 121' ' ' LEU . 39.7 mm -60.79 -54.1 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 CA-C-O 121.126 0.489 . . . . 74.530000000000001 110.984 177.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 23.2 m -68.18 -33.64 74.82 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.104 -0.498 . . . . 72.209999999999994 112.084 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.483 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.8 t70 -61.03 -52.46 64.9 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.283 -0.261 . . . . 64.540000000000006 110.788 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 81' ' ' MET . 80.4 t -64.51 -39.3 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 121.141 0.496 . . . . 72.140000000000001 110.975 178.01 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.529 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -58.93 -53.49 57.8 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.012 -0.54 . . . . 72.430000000000007 111.68 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.408 HG13 ' HB2' ' A' ' 134' ' ' ARG . 89.8 t -76.34 -33.79 24.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 N-CA-C 111.955 0.354 . . . . 65.219999999999999 111.955 -177.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 17.1 tpp180 -53.14 -33.36 52.11 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.246 0.461 . . . . 73.340000000000003 112.246 -177.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.49 -28.75 2.04 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.679 0.992 . . . . 65.409999999999997 113.679 -175.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -104.31 9.4 35.93 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 112.757 0.651 . . . . 73.540000000000006 112.757 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.408 ' HB2' HG13 ' A' ' 130' ' ' VAL . 20.3 ttt180 -50.83 -53.35 32.91 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-O 121.091 0.472 . . . . 71.519999999999996 112.245 178.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.35 -47.94 74.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.019 -0.537 . . . . 65.310000000000002 111.985 -178.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -63.45 -36.83 85.05 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 122.279 -0.263 . . . . 74.120000000000005 111.463 178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.529 HD11 ' HG ' ' A' ' 129' ' ' LEU . 73.3 mt -57.05 -51.0 71.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.75 0.309 . . . . 70.209999999999994 111.507 176.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.5 p -77.96 -40.8 27.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.836 0 N-CA-C 112.512 0.56 . . . . 73.319999999999993 112.512 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -63.0 -57.34 11.04 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 112.255 0.465 . . . . 72.129999999999995 112.255 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -84.88 -3.9 58.88 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.711 0.291 . . . . 75.25 111.324 -177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.2 mtt-85 62.29 89.71 0.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.382 0.611 . . . . 63.030000000000001 110.535 -173.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.461 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -58.97 -62.24 6.45 Favored Glycine 0 CA--C 1.521 0.438 0 CA-C-N 115.656 -0.702 . . . . 74.0 114.219 -170.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -71.55 -16.6 62.32 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.168 0.433 . . . . 71.519999999999996 112.168 -173.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -80.52 -58.08 3.28 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.989 0.423 . . . . 75.040000000000006 110.806 173.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.423 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -60.47 -34.78 86.93 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 115.876 -0.602 . . . . 65.299999999999997 113.1 179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -54.81 -49.3 71.34 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 122.963 0.505 . . . . 74.420000000000002 111.508 177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 60.5 t -70.66 -42.6 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.173 -0.467 . . . . 72.310000000000002 112.222 -176.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.603 ' HA ' ' HB2' ' A' ' 154' ' ' ASP . 12.5 pt-20 -73.34 -27.76 61.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 111.92 0.341 . . . . 75.439999999999998 111.92 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -63.69 -45.75 88.61 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.182 0.515 . . . . 63.329999999999998 110.874 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -81.85 3.43 26.08 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.231 -0.441 . . . . 72.510000000000005 111.558 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.625 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 2.0 t60 58.91 37.32 24.72 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.065 0.546 . . . . 43.149999999999999 112.057 173.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 60.6 t -71.29 -69.71 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.953 0.406 . . . . 64.409999999999997 111.772 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -96.85 -6.75 35.18 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.579 0.704 . . . . 73.519999999999996 110.4 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.625 ' HB3' ' HA ' ' A' ' 151' ' ' HIS . 4.8 t70 -69.44 169.08 13.14 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 114.965 -1.016 . . . . 23.129999999999999 113.371 -175.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.555 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -134.21 -1.62 2.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 112.906 0.706 . . . . 63.149999999999999 112.906 179.355 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 157' ' ' GLY . 12.9 pt-20 -140.31 -45.5 0.42 Allowed 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.086 -0.384 . . . . 74.530000000000001 111.888 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' A' ' 156' ' ' GLU . . . 94.2 126.12 4.45 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 121.501 -0.38 . . . . 63.450000000000003 113.883 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -70.28 70.68 0.64 Allowed Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.111 -0.566 . . . . 74.019999999999996 111.927 172.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 52.8 t-80 -76.33 -7.97 56.11 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.446 0.536 . . . . 74.040000000000006 112.446 -173.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -74.32 121.07 20.76 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.725 0.298 . . . . 73.340000000000003 111.17 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -66.75 -19.52 65.77 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.331 0.493 . . . . 72.239999999999995 112.331 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 65.31 22.44 12.06 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.521 0.677 . . . . 74.219999999999999 111.242 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -74.48 140.04 44.29 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.964 -0.562 . . . . 73.140000000000001 111.11 178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.5 p80 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 119.294 -0.384 . . . . 73.310000000000002 111.22 178.213 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptp . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 120.926 0.393 . . . . 64.219999999999999 111.545 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -123.02 142.01 51.33 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.799 0.666 . . . . 74.109999999999999 112.799 -170.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -84.17 165.09 18.72 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.71 -0.677 . . . . 74.209999999999994 110.439 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -59.29 -42.58 91.62 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.684 0.278 . . . . 74.040000000000006 110.427 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.3 tp -54.92 -40.61 70.04 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.022 0.439 . . . . 61.439999999999998 110.975 177.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -67.65 -39.6 84.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.154 -0.475 . . . . 73.230000000000004 110.999 176.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -67.65 -51.25 52.19 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.175 0.435 . . . . 63.340000000000003 112.175 179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.508 ' O ' HG13 ' A' ' 12' ' ' ILE . 53.6 tt0 -52.23 -52.04 54.76 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 120.755 0.312 . . . . 73.129999999999995 111.382 175.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.4 p -63.98 -54.63 31.38 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 111.954 0.353 . . . . 60.310000000000002 111.954 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 59.7 tp -52.89 -45.48 67.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.232 0.456 . . . . 71.400000000000006 112.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.0 tp10 -62.55 -45.46 92.83 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 120.681 0.277 . . . . 73.299999999999997 111.248 -178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 8' ' ' GLN . 86.0 mt -57.63 -51.34 71.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 121.243 0.544 . . . . 74.409999999999997 111.093 176.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.463 ' O ' HD13 ' A' ' 17' ' ' LEU . 77.8 mt -61.34 -47.87 91.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 115.759 -0.655 . . . . 65.230000000000004 111.486 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 41.8 t -54.35 -50.35 67.64 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.976 0.417 . . . . 70.409999999999997 111.467 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.709 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 35.2 mtp180 -61.33 -48.35 81.7 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.362 -0.381 . . . . 74.200000000000003 111.621 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 32.1 t80 -53.4 -48.78 68.37 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.879 0.371 . . . . 65.019999999999996 111.263 177.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.51 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.3 mp -59.61 -42.74 93.33 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 120.662 0.268 . . . . 73.150000000000006 111.421 175.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' SER . 37.2 mmt180 -60.39 -43.9 96.21 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.65 0.262 . . . . 70.129999999999995 111.429 177.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 81.1 mt-10 -63.98 -42.63 97.18 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.009 0.433 . . . . 74.420000000000002 111.488 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 27.7 mm-40 -71.99 -26.07 62.09 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.07 0.396 . . . . 75.530000000000001 112.07 -179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.427 ' O ' ' HD3' ' A' ' 110' ' ' LYS . . . -84.82 -44.39 13.31 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.33 0.492 . . . . 64.030000000000001 112.33 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.1 p -87.62 -30.19 20.65 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 112.017 0.377 . . . . 75.310000000000002 112.017 -176.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.57 -1.58 79.13 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.338 -0.458 . . . . 55.420000000000002 112.876 -176.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -94.96 -177.13 4.06 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.056 0.455 . . . . 64.439999999999998 111.983 -178.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -117.66 154.93 30.79 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.901 0.381 . . . . 72.310000000000002 111.559 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -130.32 106.64 8.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 120.98 0.419 . . . . 73.329999999999998 109.891 172.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.8 t -103.78 14.59 30.63 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.13 0.418 . . . . 74.319999999999993 112.13 -177.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.533 ' HB2' ' HZ2' ' A' ' 28' ' ' LYS . 10.2 mtmp? -76.91 164.0 61.97 Favored Pre-proline 0 CA--C 1.546 0.815 0 N-CA-C 111.656 0.243 . . . . 72.540000000000006 111.656 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.56 159.99 7.79 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.626 2.218 . . . . 71.099999999999994 112.545 174.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.709 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 25.7 tpp -117.14 -83.43 0.64 Allowed 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.409 0.522 . . . . 61.420000000000002 112.409 -173.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -122.76 -159.0 10.41 Favored Glycine 0 C--N 1.336 0.532 0 C-N-CA 121.25 -0.5 . . . . 44.310000000000002 113.178 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -83.57 -25.88 30.55 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 111.977 0.362 . . . . 62.219999999999999 111.977 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 87.8 p -58.96 -56.85 16.89 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 120.873 0.368 . . . . 74.019999999999996 111.984 177.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 106.22 -110.64 3.4 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 121.469 -0.396 . . . . 71.450000000000003 112.987 178.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.507 ' HB1' ' HE2' ' A' ' 39' ' ' LYS . . . -54.31 -39.13 66.69 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.794 0.33 . . . . 74.5 111.576 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.6 m -54.69 -52.33 62.75 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.06 0.457 . . . . 71.349999999999994 111.576 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.577 ' HB2' ' HG2' ' A' ' 30' ' ' MET . 59.6 p -67.36 -31.13 71.17 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.842 0.353 . . . . 64.120000000000005 111.856 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.443 HH11 ' HG3' ' A' ' 38' ' ' ARG . 1.1 tmm_? -66.49 -53.39 35.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.305 0.574 . . . . 73.319999999999993 110.143 178.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HE2' ' HB1' ' A' ' 35' ' ' ALA . 63.3 mttm -60.95 -39.32 89.04 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.625 -0.716 . . . . 61.030000000000001 111.268 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.86 -47.46 82.64 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.409 -0.36 . . . . 74.019999999999996 111.706 177.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.7 tp -61.38 -52.62 63.86 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 111.846 0.313 . . . . 72.450000000000003 111.846 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.97 -39.77 90.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.771 0.319 . . . . 75.400000000000006 111.226 -177.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.572 ' O ' HG22 ' A' ' 47' ' ' VAL . 63.7 m -66.15 -50.06 65.26 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.562 0.22 . . . . 53.140000000000001 110.818 177.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 19.9 mt -53.99 -45.18 71.36 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.258 0.466 . . . . 64.140000000000001 112.258 178.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HA ' ' CE1' ' A' ' 16' ' ' TYR . 5.0 ptm180 -73.97 -39.03 63.98 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 111.784 0.29 . . . . 72.340000000000003 111.784 -176.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -71.97 -35.16 69.46 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.296 -0.253 . . . . 74.430000000000007 111.679 -177.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 43' ' ' THR . 17.6 m -87.92 -33.47 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 121.043 0.449 . . . . 64.439999999999998 111.366 177.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -64.3 -42.31 97.85 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-N 116.24 -0.437 . . . . 71.049999999999997 113.507 -178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -54.5 -42.74 71.11 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-O 120.912 0.386 . . . . 72.319999999999993 111.425 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.6 -43.65 91.64 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.104 -0.569 . . . . 70.299999999999997 112.618 176.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.476 ' HA ' HD21 ' A' ' 54' ' ' ASN . 97.3 t -59.62 -41.17 84.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 120.709 0.29 . . . . 65.209999999999994 111.318 177.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 78.9 mt-30 -57.96 -41.42 82.85 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.565 -0.289 . . . . 60.5 111.573 178.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 53' ' ' ARG . 16.1 mmm-85 -61.98 -56.1 22.62 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.575 0.583 . . . . 71.239999999999995 112.575 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.476 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.6 p30 -70.81 -21.84 62.42 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 122.031 -0.418 . . . . 51.399999999999999 111.785 -177.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.0 m-70 -90.46 -20.47 22.7 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.514 0.561 . . . . 73.519999999999996 112.514 175.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -50.08 -49.57 50.95 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.729 0.64 . . . . 53.25 112.729 -171.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -58.93 -34.01 71.24 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 120.852 0.358 . . . . 71.439999999999998 111.859 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.1 -43.83 23.29 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 120.889 0.376 . . . . 74.340000000000003 111.718 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 14.2 m-30 -64.56 -39.65 94.13 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.483 -0.326 . . . . 71.200000000000003 111.373 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -53.0 -41.53 64.72 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.0 0.429 . . . . 74.209999999999994 110.816 173.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -62.74 -27.0 69.25 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 115.904 -0.589 . . . . 73.010000000000005 112.958 175.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.574 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 81.5 mtp -81.4 -51.42 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 122.637 -0.331 . . . . 74.510000000000005 110.97 177.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.9 mp -55.0 -37.44 66.6 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.542 0.571 . . . . 71.25 112.542 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 -66.41 -25.43 66.76 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 111.978 0.362 . . . . 63.200000000000003 111.978 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -96.31 -16.18 21.49 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 122.106 -0.371 . . . . 73.049999999999997 110.877 175.422 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 91.1 mt -82.31 -68.26 0.71 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.375 -0.375 . . . . 73.329999999999998 111.16 176.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.0 t70 54.37 97.71 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.389 0.614 . . . . 63.340000000000003 111.938 -178.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.504 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.3 mp -93.1 100.58 11.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 CA-C-O 121.157 0.503 . . . . 62.509999999999998 111.19 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.423 ' HD3' HD22 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -107.27 -6.58 17.15 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.174 -0.466 . . . . 74.140000000000001 112.147 179.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.423 HD22 ' HD3' ' A' ' 69' ' ' LYS . 0.8 OUTLIER -155.42 174.85 14.65 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.825 0.345 . . . . 75.140000000000001 111.37 177.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.4 -37.37 83.2 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.289 0.477 . . . . 75.299999999999997 112.289 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -54.27 -39.19 66.65 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.788 0.327 . . . . 75.340000000000003 111.487 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 68' ' ' ILE . 48.1 m-20 -63.75 -38.28 90.5 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 121.066 0.46 . . . . 64.319999999999993 110.916 178.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 97.7 t -61.38 -46.08 97.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.337 0.589 . . . . 65.299999999999997 110.844 175.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 78' ' ' SER . 98.2 mttt -70.0 -23.93 63.22 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.137 -0.483 . . . . 72.109999999999999 111.223 176.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.2 t -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.074 0.464 . . . . 74.530000000000001 110.403 170.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.522 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.5 mt -57.2 -37.93 72.93 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.345 -0.388 . . . . 62.030000000000001 110.464 174.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 38.5 t -53.25 -37.9 62.51 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.14 -0.482 . . . . 71.129999999999995 111.469 176.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -63.11 -40.27 97.12 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.197 0.522 . . . . 74.329999999999998 110.54 177.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.457 ' HA ' ' CD2' ' A' ' 83' ' ' HIS . 61.5 t -66.94 -39.79 84.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 116.072 -0.513 . . . . 64.430000000000007 110.647 175.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.543 ' HB3' HD11 ' A' ' 98' ' ' LEU . 21.4 mmt -55.39 -40.51 71.48 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 115.864 -0.607 . . . . 54.149999999999999 111.211 177.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 78' ' ' SER . 73.7 mt -60.74 -33.55 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 116.078 -0.51 . . . . 75.430000000000007 111.349 174.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.457 ' CD2' ' HA ' ' A' ' 80' ' ' VAL . 27.1 m-70 -72.8 -28.86 62.82 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.516 -0.311 . . . . 65.239999999999995 111.687 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 92.2 t -58.02 -28.84 34.9 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 121.064 0.459 . . . . 63.450000000000003 111.711 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.509 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 74.0 m-85 -89.85 10.41 23.81 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.853 0.686 . . . . 75.510000000000005 112.853 -179.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 38.1 t -53.57 -33.99 56.75 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.15 0.796 . . . . 75.120000000000005 113.15 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.631 ' HB2' ' HD3' ' A' ' 94' ' ' ARG . 6.7 m-20 -55.13 -38.11 67.79 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.712 0.634 . . . . 64.299999999999997 112.712 -178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.28 -50.38 3.43 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 120.919 -0.658 . . . . 62.030000000000001 113.339 -177.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.409 ' O ' ' NH2' ' A' ' 94' ' ' ARG . 60.9 t -48.56 134.6 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 112.498 0.555 . . . . 74.409999999999997 112.498 -178.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 90' ' ' THR . 8.1 t -67.66 86.1 0.2 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-O 122.003 0.906 . . . . 54.140000000000001 112.441 -177.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -134.08 116.49 15.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.627 -0.715 . . . . 72.319999999999993 110.83 175.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.494 ' HE3' HG13 ' A' ' 95' ' ' ILE . 81.8 m95 -63.81 -7.2 7.21 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.525 0.565 . . . . 71.010000000000005 112.525 -175.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -60.1 -31.59 73.42 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 121.189 -0.529 . . . . 71.099999999999994 112.786 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.631 ' HD3' ' HB2' ' A' ' 87' ' ' ASP . 65.8 mtm180 -66.23 -36.2 82.39 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 122.393 -0.475 . . . . 71.409999999999997 111.188 175.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.494 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.4 mm -60.82 -47.08 94.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.134 0.492 . . . . 74.200000000000003 110.501 176.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 55.7 t -59.19 -49.91 81.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.115 -0.493 . . . . 60.350000000000001 111.178 175.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.8 m -56.01 -41.96 75.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.39 -0.368 . . . . 72.019999999999996 111.473 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.543 HD11 ' HB3' ' A' ' 81' ' ' MET . 35.9 tp -61.33 -55.1 35.45 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.27 0.557 . . . . 74.439999999999998 111.896 179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.401 HG23 HG23 ' A' ' 13' ' ' ILE . 58.0 mt -72.04 -35.26 53.13 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.638 0 CA-C-N 116.14 -0.482 . . . . 73.530000000000001 111.955 -174.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.2 p -64.7 -44.89 88.81 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 120.581 0.229 . . . . 63.329999999999998 111.044 178.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -60.26 -41.32 93.01 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.797 0.332 . . . . 74.329999999999998 110.991 176.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.71 -43.83 94.33 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 120.858 -0.686 . . . . 62.439999999999998 112.468 175.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.14 -35.18 79.81 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.981 0.42 . . . . 74.219999999999999 111.439 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.413 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 51.3 t80 -62.44 -42.61 99.59 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.229 -0.441 . . . . 72.340000000000003 111.018 177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.442 ' HB ' HD11 ' A' ' 121' ' ' LEU . 47.3 t -71.46 -38.3 67.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-O 120.737 0.303 . . . . 71.349999999999994 110.863 175.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.31 -48.97 73.33 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.345 0.498 . . . . 55.130000000000003 112.345 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 19.4 ptpt -61.43 -36.16 79.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.111 0.481 . . . . 72.439999999999998 110.925 178.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -68.58 -34.72 76.3 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.376 -0.375 . . . . 74.040000000000006 110.89 176.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.498 HD11 HD12 ' A' ' 121' ' ' LEU . 90.0 mt -62.63 -50.36 71.55 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.639 0.257 . . . . 63.219999999999999 111.073 177.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.427 ' HD3' ' O ' ' A' ' 21' ' ' ALA . 56.6 tttm -61.74 -35.14 77.23 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.905 0.383 . . . . 74.400000000000006 111.041 178.54 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 74.2 m -60.48 -41.14 93.62 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 116.414 -0.357 . . . . 73.540000000000006 111.491 176.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 33.4 pt -92.94 18.88 1.01 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-O 120.864 0.364 . . . . 74.109999999999999 111.876 178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 67.59 16.21 9.85 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.182 0.808 . . . . 73.409999999999997 113.182 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -91.95 40.84 1.05 Allowed 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 120.96 0.409 . . . . 52.100000000000001 110.795 173.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -53.98 -40.8 67.21 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.017 0.527 . . . . 71.340000000000003 111.812 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 88.3 p -62.94 -33.59 75.68 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.027 0.38 . . . . 73.219999999999999 112.027 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.428 ' HB2' HD13 ' A' ' 109' ' ' LEU . 49.4 m -58.24 -26.11 62.5 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.353 0.501 . . . . 72.409999999999997 112.353 -178.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 70.0 mt -54.38 -36.03 32.75 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 N-CA-C 112.295 0.48 . . . . 62.43 112.295 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -67.08 -58.3 9.45 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 112.331 0.493 . . . . 63.219999999999999 112.331 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -57.32 -28.68 81.04 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.634 1.556 . . . . 50.140000000000001 112.092 175.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.498 HD12 HD11 ' A' ' 109' ' ' LEU . 5.0 tt -64.41 -50.45 67.55 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 110.008 -0.368 . . . . 72.109999999999999 110.008 175.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.97 -40.28 76.21 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.174 0.511 . . . . 63.439999999999998 111.137 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -68.77 -29.19 67.52 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.325 -0.398 . . . . 71.019999999999996 111.594 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 72.0 m -69.34 -43.52 73.51 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.843 0.354 . . . . 42.149999999999999 111.089 175.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.441 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.6 mm -55.73 -52.92 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-O 121.367 0.603 . . . . 65.219999999999999 110.43 174.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 9.4 m -65.43 -35.97 82.52 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.419 -0.81 . . . . 70.340000000000003 111.666 179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 26.9 t70 -57.53 -52.54 64.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.733 0.302 . . . . 74.530000000000001 110.996 178.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 132' ' ' THR . 62.1 t -64.36 -42.8 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-O 120.937 0.399 . . . . 73.099999999999994 111.053 178.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.532 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -53.89 -52.84 59.24 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.335 0.588 . . . . 72.439999999999998 111.351 178.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.76 -30.74 34.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.856 -0.611 . . . . 62.240000000000002 111.376 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 7.1 tpt180 -57.47 -49.69 75.47 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.121 0.486 . . . . 63.140000000000001 112.179 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.9 t -104.39 -29.56 10.66 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 113.906 1.076 . . . . 70.519999999999996 113.906 -172.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -130.47 22.44 5.13 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.081 1.141 . . . . 74.5 114.081 -171.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.515 ' HA ' HD12 ' A' ' 137' ' ' LEU . 33.8 ttp180 -54.47 -43.35 71.64 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-O 121.011 0.434 . . . . 71.129999999999995 111.983 175.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 33.8 t70 -58.65 -49.58 77.0 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.21 -0.45 . . . . 65.310000000000002 111.525 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -65.46 -35.74 81.82 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 111.774 0.287 . . . . 72.420000000000002 111.774 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.532 HD11 ' HG ' ' A' ' 129' ' ' LEU . 55.9 mt -51.81 -48.45 63.87 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.661 0.267 . . . . 72.319999999999993 111.501 174.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.79 -31.85 15.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 112.446 0.536 . . . . 63.140000000000001 112.446 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 45.1 mmtm -65.47 -64.33 0.89 Allowed 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.965 -0.46 . . . . 71.329999999999998 112.186 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -85.6 4.02 38.11 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 116.419 -0.355 . . . . 75.25 111.247 -176.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 51.49 72.17 0.39 Allowed 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.231 0.539 . . . . 72.230000000000004 110.084 -172.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.33 -50.29 6.63 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 115.218 -0.901 . . . . 70.010000000000005 114.793 -171.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.457 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.5 m95 -72.95 -26.26 61.32 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 112.32 0.489 . . . . 74.530000000000001 112.32 -175.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -76.42 -53.93 7.45 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.279 0.562 . . . . 72.239999999999995 110.587 173.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.446 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -58.39 -33.64 71.82 Favored Glycine 0 CA--C 1.524 0.656 0 CA-C-N 115.716 -0.675 . . . . 71.409999999999997 112.673 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -56.56 -45.71 81.13 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.301 0.572 . . . . 74.430000000000007 111.58 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.499 HG13 ' HB ' ' A' ' 152' ' ' VAL . 47.2 t -70.26 -42.34 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.941 -0.572 . . . . 65.120000000000005 112.026 -177.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.446 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.8 pt-20 -73.34 -27.89 61.76 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.783 0.325 . . . . 74.409999999999997 111.36 177.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.405 ' HE1' ' HD2' ' A' ' 163' ' ' HIS . 82.0 t80 -61.89 -48.96 78.16 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 122.575 0.35 . . . . 71.450000000000003 111.675 178.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -83.21 -10.99 58.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 111.961 0.356 . . . . 64.319999999999993 111.961 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.439 ' CG ' ' HA3' ' A' ' 158' ' ' GLY . 22.2 t-160 65.75 74.83 0.36 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.197 0.522 . . . . 62.509999999999998 111.405 -177.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.499 ' HB ' HG13 ' A' ' 147' ' ' VAL . 59.9 t -111.17 -68.77 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 73.310000000000002 110.158 174.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.463 ' HG3' HG12 ' A' ' 152' ' ' VAL . 65.7 mt-10 -137.84 84.76 2.06 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.096 0.474 . . . . 75.5 111.228 174.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -102.62 -164.68 1.11 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.117 -0.492 . . . . 73.510000000000005 110.516 173.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.54 HD22 ' HG3' ' A' ' 156' ' ' GLU . 0.0 OUTLIER -124.83 11.96 8.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.28 0.474 . . . . 74.109999999999999 112.28 -178.033 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.54 ' HG3' HD22 ' A' ' 155' ' ' LEU . 43.9 mt-10 -115.99 -71.58 0.73 Allowed 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.341 0.591 . . . . 74.120000000000005 111.155 177.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 170.83 26.36 0.02 OUTLIER Glycine 0 CA--C 1.527 0.781 0 CA-C-N 115.615 -0.72 . . . . 73.519999999999996 112.51 -178.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . 0.439 ' HA3' ' CG ' ' A' ' 151' ' ' HIS . . . 75.94 148.36 2.24 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 113.951 0.341 . . . . 73.129999999999995 113.951 -176.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 22.4 m170 -72.37 141.4 48.75 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.931 0.396 . . . . 72.510000000000005 110.727 175.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 43.4 t60 -76.23 -37.67 57.4 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.422 -0.354 . . . . 74.230000000000004 111.687 -175.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -138.54 135.7 35.31 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.786 0.326 . . . . 74.420000000000002 111.026 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 149' ' ' PHE . 69.4 m-70 -84.07 71.45 10.55 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.745 0.307 . . . . 72.340000000000003 111.099 -175.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.405 ' HD2' ' HE1' ' A' ' 149' ' ' PHE . 67.9 m-70 58.0 12.44 1.8 Allowed 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 120.844 0.354 . . . . 53.200000000000003 111.884 -173.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.361 -0.828 . . . . 72.299999999999997 110.595 -178.995 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 120.724 0.297 . . . . 72.310000000000002 111.5 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.91 148.43 27.68 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.172 0.51 . . . . 75.519999999999996 112.087 -175.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -89.79 156.75 18.3 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 116.042 -0.526 . . . . 72.450000000000003 110.668 176.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -55.52 -41.58 73.31 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.891 0.377 . . . . 44.210000000000001 111.305 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.6 tp -55.93 -46.79 78.37 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.045 -0.525 . . . . 40.43 110.9 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -62.72 -43.26 99.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.155 -0.475 . . . . 73.0 110.879 177.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 7' ' ' ARG . 0.7 OUTLIER -58.47 -44.63 89.38 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.341 0.497 . . . . 52.109999999999999 112.341 177.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.441 ' O ' HG13 ' A' ' 12' ' ' ILE . 47.7 tt0 -73.15 -45.03 59.03 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 111.707 0.262 . . . . 61.340000000000003 111.707 -179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.0 p -60.91 -53.1 61.45 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.695 0.283 . . . . 62.240000000000002 111.148 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.9 tp -54.53 -40.83 69.03 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.379 -0.373 . . . . 54.229999999999997 111.559 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.538 ' HG2' ' HA2' ' A' ' 31' ' ' GLY . 9.8 tp10 -57.39 -51.64 68.6 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 121.132 0.491 . . . . 65.010000000000005 111.317 178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 8' ' ' GLN . 57.2 mt -64.21 -49.75 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 116.043 -0.526 . . . . 74.109999999999999 111.37 -178.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.417 ' O ' HD13 ' A' ' 17' ' ' LEU . 86.0 mt -62.32 -47.29 93.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 116.224 -0.444 . . . . 72.030000000000001 111.662 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.536 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 39.3 t -54.66 -54.6 39.57 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.512 -0.313 . . . . 73.430000000000007 111.642 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.465 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 71.0 mtp180 -60.27 -45.84 91.89 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.666 -0.243 . . . . 73.25 111.499 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -56.12 -48.54 76.01 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.884 0.373 . . . . 71.099999999999994 111.555 179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.498 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.1 mp -59.39 -41.89 90.44 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.741 -0.209 . . . . 73.439999999999998 111.452 176.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 14' ' ' SER . 22.1 mmm180 -63.79 -55.36 23.64 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 111.688 0.255 . . . . 73.409999999999997 111.688 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 6.9 pt-20 -61.62 -40.6 95.43 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.015 0.376 . . . . 74.200000000000003 112.015 -177.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.7 mm-40 -70.66 -22.74 62.46 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 122.161 -0.337 . . . . 74.519999999999996 111.439 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -80.04 -43.06 22.55 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 111.88 0.326 . . . . 75.319999999999993 111.88 177.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 45.5 p -87.4 -16.83 33.78 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.924 0.392 . . . . 70.310000000000002 111.662 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.91 7.79 88.17 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 121.105 -0.569 . . . . 74.109999999999999 112.527 -176.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.95 141.4 38.43 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.482 . . . . 64.540000000000006 111.581 -177.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.9 mtpt -80.83 156.13 26.27 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.016 -0.538 . . . . 75.329999999999998 111.8 -177.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -101.59 -172.48 2.16 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.673 0.273 . . . . 71.129999999999995 110.743 175.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.2 t -143.27 48.55 1.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.657 0.741 . . . . 62.520000000000003 112.294 179.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -87.99 160.56 46.16 Favored Pre-proline 0 N--CA 1.477 0.918 0 O-C-N 122.035 -0.416 . . . . 72.129999999999995 112.026 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -64.41 118.17 5.16 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 122.338 2.025 . . . . 75.109999999999999 111.308 175.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.465 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 13.6 tpt -83.23 106.64 15.18 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 114.442 1.275 . . . . 74.409999999999997 114.442 -164.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.538 ' HA2' ' HG2' ' A' ' 11' ' ' GLU . . . 67.12 179.43 12.04 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 115.853 1.101 . . . . 61.439999999999998 115.853 167.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.02 -40.63 16.65 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.225 -0.487 . . . . 62.020000000000003 110.89 177.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.9 t -72.87 -28.21 62.37 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 116.212 -0.449 . . . . 70.030000000000001 111.752 178.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.96 -97.42 1.97 Allowed Glycine 0 CA--C 1.525 0.718 0 C-N-CA 121.064 -0.589 . . . . 52.119999999999997 113.164 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.38 -49.67 75.44 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 112.183 0.438 . . . . 73.439999999999998 112.183 -176.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 89.4 m -60.47 -41.06 93.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.092 0.472 . . . . 64.120000000000005 111.107 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 39.3 m -62.99 -42.39 99.83 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.273 -0.422 . . . . 74.340000000000003 111.15 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.9 ttt180 -63.55 -55.95 19.79 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.888 0.375 . . . . 65.329999999999998 111.572 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HG3' HG21 ' A' ' 147' ' ' VAL . 3.2 ptmm? -63.18 -29.36 70.72 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.34 -0.391 . . . . 73.209999999999994 111.404 -174.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.71 -44.16 82.36 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.929 0.395 . . . . 74.010000000000005 111.06 173.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 63.2 tp -59.22 -54.39 47.43 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.306 -0.407 . . . . 71.319999999999993 111.92 179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.37 -24.79 64.83 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.025 0.379 . . . . 75.519999999999996 112.025 -179.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.495 HG23 HG21 ' A' ' 152' ' ' VAL . 28.3 m -66.49 -42.52 87.28 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 122.106 -0.371 . . . . 75.450000000000003 110.3 169.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 44.4 mt -56.41 -31.89 64.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.691 0.282 . . . . 53.409999999999997 111.513 174.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -68.76 -54.45 15.94 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.289 0.566 . . . . 61.130000000000003 110.68 174.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 24.3 ttt180 -56.46 -44.84 80.91 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 115.287 -0.869 . . . . 63.530000000000001 112.416 -177.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 43' ' ' THR . 15.6 m -93.72 -33.08 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 112.179 0.437 . . . . 74.010000000000005 112.179 -178.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -65.63 -49.52 59.52 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.229 -0.51 . . . . 65.439999999999998 113.602 -174.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.541 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 14.8 t70 -61.57 -35.99 79.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 117.223 0.512 . . . . 64.310000000000002 110.751 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.9 -50.15 70.83 Favored Glycine 0 CA--C 1.527 0.827 0 C-N-CA 121.075 -0.583 . . . . 75.030000000000001 112.089 174.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.491 ' HA ' HD21 ' A' ' 54' ' ' ASN . 86.8 t -58.23 -38.46 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 120.831 0.348 . . . . 74.120000000000005 111.192 176.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.4 mt-30 -57.01 -50.56 72.34 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.616 -0.265 . . . . 73.310000000000002 111.2 175.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 15.2 mmp_? -55.26 -50.18 70.14 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.904 0.705 . . . . 73.219999999999999 112.904 -175.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.491 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -78.39 -23.1 46.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 112.59 0.589 . . . . 71.420000000000002 112.59 -177.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -91.68 -16.96 26.2 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.629 0.603 . . . . 72.099999999999994 112.629 175.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -48.61 -57.95 5.44 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 113.508 0.929 . . . . 74.030000000000001 113.508 -167.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.0 t -62.49 -31.36 72.09 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.08 0.466 . . . . 63.450000000000003 111.523 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.41 -30.5 67.4 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 120.988 0.423 . . . . 61.340000000000003 111.216 177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -76.98 -43.04 36.46 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.422 -0.354 . . . . 72.420000000000002 111.224 175.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -52.05 -40.0 60.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.825 0.345 . . . . 64.120000000000005 111.49 177.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.94 -33.36 56.8 Favored Glycine 0 CA--C 1.53 0.978 0 C-N-CA 121.4 -0.429 . . . . 72.549999999999997 113.603 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 67.0 mtm -91.0 -37.29 13.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.494 0.664 . . . . 71.25 110.44 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 63' ' ' LEU . 13.4 tp -63.44 -38.08 89.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.483 -0.78 . . . . 72.530000000000001 111.786 -174.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -56.72 -39.8 74.55 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.232 -0.44 . . . . 73.049999999999997 112.183 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.23 -2.62 58.05 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.833 0.349 . . . . 74.129999999999995 111.636 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.1 mt -95.09 -75.7 0.51 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.94 0.4 . . . . 75.010000000000005 110.99 174.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 43.34 83.37 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.48 -0.782 . . . . 62.340000000000003 111.063 -173.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.602 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.6 mp -60.31 113.61 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.716 -0.675 . . . . 72.510000000000005 112.031 -172.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -104.32 -8.98 18.86 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.986 -0.552 . . . . 61.340000000000003 112.155 -179.497 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.429 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -166.35 179.75 5.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.911 0.386 . . . . 45.310000000000002 111.759 173.721 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 55.2 tt0 -53.63 -38.8 64.41 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.563 0.579 . . . . 71.099999999999994 112.563 -178.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.16 -39.21 63.41 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 120.825 0.345 . . . . 61.25 111.79 -178.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.546 ' HB2' HG23 ' A' ' 68' ' ' ILE . 21.7 m-20 -69.26 -34.47 74.82 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 120.947 0.404 . . . . 73.140000000000001 110.812 178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.6 t -61.55 -39.58 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.271 0.557 . . . . 75.310000000000002 110.324 175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -62.95 -38.83 92.66 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.174 0.511 . . . . 74.439999999999998 110.451 173.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 45.7 t -62.86 -34.14 76.75 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 116.095 -0.502 . . . . 62.520000000000003 111.33 174.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.498 HD21 HD11 ' A' ' 68' ' ' ILE . 90.4 mt -62.48 -40.01 95.32 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.734 0.302 . . . . 71.239999999999995 111.024 175.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.5 t -52.53 -38.54 59.89 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 121.176 0.513 . . . . 71.230000000000004 111.194 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -58.09 -41.03 82.6 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.051 -0.522 . . . . 73.310000000000002 110.894 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.06 -41.29 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 120.951 0.405 . . . . 63.200000000000003 110.725 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.2 mmt -54.7 -40.68 69.41 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.992 -0.549 . . . . 73.0 111.241 178.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 77.9 mt -64.31 -32.67 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 CA-C-O 121.085 0.469 . . . . 60.310000000000002 111.313 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -74.31 -27.67 60.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 111.829 0.307 . . . . 61.520000000000003 111.829 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 67.9 t -57.66 -43.01 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 121.091 0.472 . . . . 71.340000000000003 111.342 176.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.502 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.2 m-85 -82.5 44.05 0.86 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.033 0.444 . . . . 73.519999999999996 111.963 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 22.7 t -71.51 -0.85 11.47 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.446 0.536 . . . . 62.119999999999997 112.446 -178.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -147.01 -174.62 4.54 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.977 0.418 . . . . 64.019999999999996 111.664 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -140.19 56.67 0.61 Allowed Glycine 0 CA--C 1.527 0.842 0 C-N-CA 120.936 -0.65 . . . . 62.140000000000001 113.799 179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.53 HG22 ' H ' ' A' ' 91' ' ' ASN . 15.0 p -73.29 147.76 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 CA-C-N 116.931 0.365 . . . . 70.230000000000004 111.278 176.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 75.1 p -69.76 -6.61 33.24 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.425 0.528 . . . . 75.209999999999994 112.425 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.53 ' H ' HG22 ' A' ' 89' ' ' VAL . 79.9 m-20 -77.93 150.85 33.96 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.083 0.468 . . . . 72.049999999999997 111.592 177.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.488 ' HE3' HG13 ' A' ' 95' ' ' ILE . 96.6 m95 -93.69 -2.68 53.57 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 112.423 0.527 . . . . 72.540000000000006 112.423 -177.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.36 -35.78 51.46 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.239 -0.505 . . . . 62.039999999999999 113.05 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -56.65 -43.05 79.94 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 120.942 0.401 . . . . 73.120000000000005 111.592 174.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' HE3' ' A' ' 92' ' ' TRP . 43.9 mm -66.68 -43.29 90.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.368 0 CA-C-O 121.078 0.465 . . . . 72.209999999999994 110.322 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 45.9 t -57.38 -42.32 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 116.026 -0.534 . . . . 72.040000000000006 110.595 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.3 m -57.4 -46.76 83.13 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.186 -0.461 . . . . 72.420000000000002 111.417 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.506 ' HG ' HG23 ' A' ' 125' ' ' ILE . 31.2 tp -58.35 -54.52 46.07 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.142 0.496 . . . . 70.319999999999993 111.381 178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.2 mt -65.53 -37.96 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 116.055 -0.52 . . . . 74.030000000000001 111.959 -177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 73.4 m -63.19 -45.82 89.94 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 116.565 -0.289 . . . . 71.299999999999997 111.355 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -65.49 -39.5 91.97 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 120.768 0.318 . . . . 75.540000000000006 110.863 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.87 -47.93 85.58 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.962 -0.637 . . . . 54.399999999999999 112.377 175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.498 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -66.35 -32.29 73.6 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 120.854 0.359 . . . . 75.439999999999998 111.341 176.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.456 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 39.0 t80 -63.51 -42.84 98.47 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.081 0.467 . . . . 51.5 111.12 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.491 HG11 HD11 ' A' ' 77' ' ' LEU . 45.5 t -72.2 -40.47 66.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-O 120.932 0.396 . . . . 72.299999999999997 110.674 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.442 ' HB1' HG23 ' A' ' 118' ' ' ILE . . . -58.3 -45.3 88.26 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.139 -0.482 . . . . 63.020000000000003 112.291 -179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 17.1 ptmt -64.12 -32.94 74.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 120.783 0.325 . . . . 71.299999999999997 111.031 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.31 -34.24 75.77 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 120.748 0.309 . . . . 55.219999999999999 110.553 173.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.602 HD21 ' HB ' ' A' ' 68' ' ' ILE . 92.9 mt -61.82 -49.23 77.12 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.747 0.308 . . . . 72.450000000000003 111.148 176.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.425 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 8.5 tmtm? -54.29 -44.3 71.8 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 110.066 -0.346 . . . . 74.329999999999998 110.066 176.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.7 m -52.67 -50.53 63.08 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 116.223 -0.444 . . . . 53.130000000000003 111.863 175.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 38.6 pt -87.29 15.78 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 N-CA-C 112.562 0.578 . . . . 74.430000000000007 112.562 -178.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.4 m-80 68.51 18.29 8.95 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.938 0.718 . . . . 73.239999999999995 112.938 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -91.66 43.27 1.13 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.011 0.434 . . . . 71.010000000000005 111.265 174.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.91 -17.54 61.9 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.078 0.399 . . . . 64.409999999999997 112.078 -176.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.446 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 72.2 p -71.48 -48.3 50.03 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.91 0.386 . . . . 73.510000000000005 111.012 173.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.487 ' HB2' HD13 ' A' ' 109' ' ' LEU . 24.5 m -56.7 -28.23 60.47 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.061 -0.518 . . . . 73.530000000000001 111.991 -177.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.442 HG23 ' HB1' ' A' ' 106' ' ' ALA . 70.9 mt -55.45 -40.95 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 N-CA-C 112.639 0.607 . . . . 71.150000000000006 112.639 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -67.06 -53.95 22.75 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 112.203 0.445 . . . . 63.219999999999999 112.203 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.446 ' HD2' ' O ' ' A' ' 116' ' ' SER . 23.5 Cg_endo -62.02 -25.04 77.31 Favored 'Trans proline' 0 C--N 1.36 1.171 0 C-N-CA 121.579 1.519 . . . . 64.239999999999995 112.438 173.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 109' ' ' LEU . 3.9 tt -61.25 -46.48 90.19 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.698 -0.482 . . . . 73.540000000000006 109.698 174.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.05 -33.75 65.28 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.052 0.453 . . . . 64.530000000000001 111.439 175.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -68.18 -39.44 82.51 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 111.914 177.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 98.3 p -63.35 -47.48 81.95 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 117.815 0.28 . . . . 63.310000000000002 111.099 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.506 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.9 mm -52.86 -53.23 22.34 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.384 0.611 . . . . 74.209999999999994 111.028 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.8 m -66.67 -35.83 81.09 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.671 -0.695 . . . . 65.510000000000005 111.612 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.617 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 33.3 t70 -61.0 -53.0 62.63 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.755 -0.202 . . . . 72.549999999999997 110.912 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.2 t -63.75 -41.42 92.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 CA-C-O 120.95 0.405 . . . . 55.420000000000002 111.097 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.6 ' HG ' HD11 ' A' ' 137' ' ' LEU . 24.8 tp -52.9 -52.52 57.28 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-O 121.284 0.564 . . . . 61.009999999999998 111.036 177.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 89.2 t -74.16 -35.22 40.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.97 -0.559 . . . . 55.140000000000001 111.576 177.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.617 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.1 ttt180 -54.83 -32.8 60.95 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.114 0.566 . . . . 73.129999999999995 112.106 -175.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.75 HG23 ' HD2' ' A' ' 133' ' ' LYS . 1.6 t -127.1 -18.97 4.46 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.765 1.024 . . . . 52.520000000000003 113.765 -177.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.75 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.3 mptp? -123.68 20.95 9.34 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.17 0.804 . . . . 74.430000000000007 113.17 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 48.3 ttp180 -45.66 -64.11 0.81 Allowed 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.228 0.537 . . . . 72.109999999999999 112.424 178.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.12 -40.24 93.04 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.742 -0.663 . . . . 73.5 111.826 -176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -60.04 -42.07 93.62 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 122.239 -0.288 . . . . 71.109999999999999 111.61 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.6 HD11 ' HG ' ' A' ' 129' ' ' LEU . 83.3 mt -53.18 -52.53 58.54 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 120.942 0.401 . . . . 75.209999999999994 111.523 177.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.13 -38.33 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.755 0 N-CA-C 112.326 0.491 . . . . 53.409999999999997 112.326 -176.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -65.11 -40.99 95.3 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.22 0.452 . . . . 70.120000000000005 112.22 -177.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -89.76 0.94 56.69 Favored 'General case' 0 N--CA 1.471 0.609 0 O-C-N 122.352 -0.217 . . . . 74.040000000000006 111.576 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 64.8 mtt180 55.16 74.06 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.614 0.721 . . . . 65.420000000000002 110.07 -173.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.435 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -53.47 -68.58 1.56 Allowed Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.97 -1.014 . . . . 44.229999999999997 115.173 -168.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 32.2 m95 -67.16 -12.42 59.97 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 112.156 0.428 . . . . 74.099999999999994 112.156 -173.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -84.42 -58.37 2.77 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.993 0.425 . . . . 71.349999999999994 110.566 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.545 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -62.58 -30.27 76.12 Favored Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.029 -0.532 . . . . 72.420000000000002 113.053 178.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -53.96 -47.7 71.06 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.338 0.589 . . . . 63.009999999999998 111.474 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.634 HG21 ' HG3' ' A' ' 39' ' ' LYS . 24.3 t -73.79 -39.46 52.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-N 115.867 -0.606 . . . . 71.439999999999998 112.293 -174.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.59 ' HB2' ' HA3' ' A' ' 157' ' ' GLY . 9.2 pt-20 -66.91 -38.65 86.62 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.825 0.345 . . . . 70.329999999999998 110.677 176.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.434 ' N ' ' HG3' ' A' ' 148' ' ' GLU . 84.3 t80 -53.69 -48.02 69.92 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.286 -0.416 . . . . 64.109999999999999 111.716 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -82.41 -5.47 58.67 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 120.791 0.329 . . . . 72.400000000000006 111.634 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.412 ' HE1' ' HA2' ' A' ' 158' ' ' GLY . 29.6 m-70 59.31 26.41 15.25 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.375 0.67 . . . . 73.409999999999997 112.373 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.495 HG21 HG23 ' A' ' 43' ' ' THR . 96.7 t -57.6 -44.27 84.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.023 0.44 . . . . 73.019999999999996 112.053 -176.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -131.18 -45.29 1.02 Allowed 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.304 0.573 . . . . 75.310000000000002 110.563 176.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.96 67.03 6.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.406 0.622 . . . . 54.210000000000001 111.546 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.447 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -61.36 -26.06 67.58 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.048 -0.523 . . . . 55.140000000000001 112.015 -179.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.436 ' N ' HD22 ' A' ' 155' ' ' LEU . 10.4 pt-20 -66.89 -14.88 63.22 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.871 0.323 . . . . 73.109999999999999 111.871 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . 0.59 ' HA3' ' HB2' ' A' ' 148' ' ' GLU . . . -91.88 97.85 2.35 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 121.299 -0.477 . . . . 70.040000000000006 112.276 175.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . 0.412 ' HA2' ' HE1' ' A' ' 151' ' ' HIS . . . -128.22 49.38 0.93 Allowed Glycine 0 CA--C 1.525 0.7 0 C-N-CA 121.07 -0.586 . . . . 62.009999999999998 113.096 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -74.24 88.69 2.01 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 122.322 -0.516 . . . . 62.25 111.988 -178.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 68.3 m80 -78.16 156.92 29.6 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.947 0.403 . . . . 72.040000000000006 111.553 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -136.97 111.11 8.34 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.772 0.32 . . . . 73.239999999999995 111.835 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -159.63 112.92 2.22 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.93 0.395 . . . . 74.510000000000005 111.161 173.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -93.8 160.97 14.51 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.255 -0.43 . . . . 72.209999999999994 111.311 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.8 p80 . . . . . 0 C--O 1.252 1.211 0 CA-C-N 116.317 -0.401 . . . . 72.530000000000001 111.676 -179.345 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.9 mmm . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.962 0.41 . . . . 63.109999999999999 110.464 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -164.11 -165.85 1.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.134 0.492 . . . . 73.530000000000001 111.741 -171.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -101.87 156.24 17.64 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.174 -0.466 . . . . 74.340000000000003 110.985 179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -54.28 -43.88 71.43 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.14 0.495 . . . . 65.340000000000003 111.245 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.582 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.2 tp -59.75 -34.91 73.58 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.839 -0.618 . . . . 73.019999999999996 111.437 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -66.65 -46.03 77.06 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.37 -0.377 . . . . 65.340000000000003 110.331 177.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -60.75 -43.64 97.7 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.972 0.415 . . . . 75.150000000000006 111.22 177.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.473 ' OE1' ' HB2' ' A' ' 32' ' ' ARG . 7.1 tp60 -56.17 -53.71 53.91 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.343 0.592 . . . . 71.340000000000003 111.131 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.3 m -64.98 -43.78 91.49 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.659 -0.7 . . . . 55.439999999999998 111.495 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.78 -44.69 93.78 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.377 -0.374 . . . . 75.439999999999998 111.555 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' A' ' 31' ' ' GLY . 5.6 tp10 -57.35 -51.35 69.77 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.263 0.554 . . . . 74.030000000000001 111.193 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.449 HG23 ' HB2' ' A' ' 41' ' ' LEU . 68.1 mt -59.85 -54.06 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 115.93 -0.577 . . . . 74.239999999999995 111.6 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.475 HD13 HG22 ' A' ' 125' ' ' ILE . 81.1 mt -61.99 -42.26 94.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 116.132 -0.485 . . . . 72.420000000000002 111.822 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.8 t -55.07 -53.88 50.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.89 0.376 . . . . 71.129999999999995 111.836 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.1 mtt180 -62.69 -39.15 93.09 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.552 -0.295 . . . . 62.509999999999998 111.511 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HA ' ' HG2' ' A' ' 19' ' ' GLU . 57.0 t80 -59.85 -49.06 79.19 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.09 0.471 . . . . 71.109999999999999 111.489 178.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.0 mp -62.71 -38.13 89.24 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.765 0.317 . . . . 73.319999999999993 111.211 177.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -65.73 -43.31 89.41 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.011 0.375 . . . . 62.450000000000003 112.011 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.506 ' HG3' ' N ' ' A' ' 20' ' ' GLN . 3.2 pt-20 -69.49 -39.65 77.51 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 122.109 -0.369 . . . . 74.299999999999997 111.571 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.506 ' N ' ' HG3' ' A' ' 19' ' ' GLU . 37.6 mm-40 -71.43 -28.08 63.73 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.788 0.328 . . . . 74.019999999999996 111.397 178.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.57 -41.87 44.83 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 111.872 0.323 . . . . 62.200000000000003 111.872 177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 70.3 p -88.27 -29.97 20.0 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.032 0.444 . . . . 63.109999999999999 112.184 -178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.87 12.21 59.42 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 121.427 -0.416 . . . . 42.310000000000002 112.398 -174.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -143.08 127.17 17.44 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.736 0.303 . . . . 44.149999999999999 111.588 -178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.95 162.26 13.09 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.859 0.362 . . . . 74.519999999999996 111.133 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -112.71 -175.33 2.65 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.354 0.597 . . . . 71.319999999999993 111.916 -177.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.1 t -141.71 23.98 2.07 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.773 -0.649 . . . . 72.120000000000005 110.135 174.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' A' ' 28' ' ' LYS . 42.1 mtmt -64.65 154.24 85.4 Favored Pre-proline 0 N--CA 1.467 0.422 0 CA-C-N 115.698 -0.683 . . . . 64.430000000000007 111.253 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -49.44 126.94 16.96 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 122.615 2.21 . . . . 73.109999999999999 112.257 177.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.6 tpt -78.07 148.7 34.15 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.656 -0.247 . . . . 64.5 111.422 -173.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.471 ' H ' ' HG2' ' A' ' 11' ' ' GLU . . . -50.01 -76.51 0.16 Allowed Glycine 0 CA--C 1.531 1.069 0 N-CA-C 115.243 0.857 . . . . 42.310000000000002 115.243 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.473 ' HB2' ' OE1' ' A' ' 8' ' ' GLN . 4.8 mmp_? -86.77 -82.08 0.21 Allowed 'General case' 0 CA--C 1.543 0.686 0 O-C-N 122.327 -0.514 . . . . 74.25 112.009 -176.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.9 m -81.22 177.64 8.88 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 120.893 0.378 . . . . 73.0 111.887 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -109.84 -76.14 0.87 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.262 -0.494 . . . . 34.439999999999998 112.797 176.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.89 -49.33 68.44 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.152 0.427 . . . . 75.219999999999999 112.152 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.575 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . 59.8 m -59.53 -52.04 67.26 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.276 0.472 . . . . 75.349999999999994 112.276 -177.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.9 p -61.05 -45.48 94.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.296 -0.411 . . . . 75.049999999999997 111.461 -178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -46.27 81.7 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 111.864 0.32 . . . . 75.019999999999996 111.864 179.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.669 ' HG3' HG21 ' A' ' 147' ' ' VAL . 24.2 pttm -67.17 -28.8 68.41 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 122.088 -0.382 . . . . 73.150000000000006 111.62 -178.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.32 -51.92 64.01 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 120.925 0.393 . . . . 74.420000000000002 110.498 173.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB2' HG23 ' A' ' 12' ' ' ILE . 65.5 tp -59.01 -44.85 91.76 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.31 0.576 . . . . 72.510000000000005 111.208 175.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.37 -41.2 88.78 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.781 -0.645 . . . . 74.25 111.161 -179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.1 m -72.1 -38.35 69.35 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.315 -0.402 . . . . 54.32 111.02 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.0 mt -53.64 -47.05 70.68 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 111.944 0.35 . . . . 72.209999999999994 111.944 177.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -74.14 -29.78 61.97 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.774 0.321 . . . . 74.310000000000002 111.42 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.4 tpm_? -63.45 -45.1 92.42 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-O 120.796 0.331 . . . . 72.310000000000002 111.396 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.84 -30.4 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.028 0.442 . . . . 71.439999999999998 111.468 178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.39 -44.39 97.65 Favored Glycine 0 CA--C 1.52 0.406 0 CA-C-N 115.921 -0.582 . . . . 61.039999999999999 112.953 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 23.1 t70 -50.84 -57.37 8.62 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.837 0.351 . . . . 64.209999999999994 110.955 176.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.07 -45.13 92.75 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 121.399 -0.429 . . . . 45.439999999999998 113.548 -179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 85.1 t -62.92 -42.62 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.883 0.373 . . . . 64.549999999999997 111.508 178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.502 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 27.8 mt-30 -66.74 -27.5 67.66 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 112.024 0.379 . . . . 75.540000000000006 112.024 178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 21.6 mmt180 -64.07 -42.84 96.84 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.916 0.389 . . . . 73.510000000000005 111.193 175.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -84.05 -49.82 8.55 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.117 0.484 . . . . 72.329999999999998 112.272 -176.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -75.06 -20.99 59.29 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.317 0.858 . . . . 72.040000000000006 113.317 -172.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' O ' ' A' ' 52' ' ' GLN . 42.7 tt0 -50.49 -52.51 37.66 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.102 0.408 . . . . 64.129999999999995 112.102 -176.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.8 t -55.69 -36.96 67.71 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 120.962 0.41 . . . . 61.020000000000003 111.824 179.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.3 -40.32 62.33 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 120.916 0.389 . . . . 74.209999999999994 111.565 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -66.17 -37.94 86.84 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.545 -0.298 . . . . 65.329999999999998 111.507 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.625 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 79.4 mm-40 -48.86 -49.49 39.24 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.792 0.329 . . . . 74.519999999999996 111.175 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -32.28 52.93 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.242 -0.436 . . . . 53.109999999999999 113.689 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.408 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 46.2 mtm -89.37 -30.22 18.54 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 121.241 0.543 . . . . 73.219999999999999 110.356 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.8 tp -63.04 -30.78 71.87 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.887 -0.597 . . . . 63.229999999999997 111.021 -178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.625 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 61.6 mtp180 -68.24 -16.55 64.01 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.934 -0.576 . . . . 72.140000000000001 112.222 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -109.37 5.85 23.86 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.001 0.429 . . . . 72.040000000000006 111.332 176.104 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 98.5 mt -103.85 -73.72 0.66 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.292 -0.413 . . . . 75.230000000000004 111.226 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 38.26 87.06 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 113.125 0.787 . . . . 74.200000000000003 113.125 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.538 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.9 mp -65.92 113.5 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 115.401 -0.818 . . . . 75.450000000000003 112.065 -176.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -99.91 -6.03 27.37 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.375 -0.375 . . . . 53.43 111.641 177.581 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.565 HD21 ' HB3' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -173.36 174.62 3.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 120.932 0.396 . . . . 72.349999999999994 111.644 172.009 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -50.84 -30.48 14.52 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.493 0.553 . . . . 73.420000000000002 112.493 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.565 ' HB3' HD21 ' A' ' 70' ' ' ASN . 29.8 t70 -52.99 -41.75 64.9 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-O 121.122 0.487 . . . . 71.340000000000003 111.444 176.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.538 ' HB2' HG23 ' A' ' 68' ' ' ILE . 17.4 m-20 -73.18 -28.42 62.2 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.301 -0.409 . . . . 62.299999999999997 111.122 179.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 88.2 t -62.19 -40.92 89.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-O 121.299 0.571 . . . . 74.230000000000004 110.386 173.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -66.99 -30.72 70.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.042 -0.526 . . . . 74.340000000000003 110.851 174.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.5 t -66.06 -37.63 86.3 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 121.181 0.515 . . . . 51.420000000000002 110.529 171.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.477 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.4 mt -62.13 -38.11 87.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 116.225 -0.443 . . . . 70.530000000000001 110.873 174.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 31.8 t -52.74 -41.02 63.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.983 0.42 . . . . 72.310000000000002 111.198 177.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.2 mmt180 -55.5 -47.24 76.5 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 116.212 -0.449 . . . . 74.310000000000002 110.752 175.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.4 ' HA ' ' HD2' ' A' ' 83' ' ' HIS . 64.9 t -63.61 -41.79 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 CA-C-O 120.969 0.414 . . . . 54.409999999999997 111.007 176.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.488 ' SD ' HD12 ' A' ' 98' ' ' LEU . 22.8 mmt -56.18 -41.99 76.39 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.046 -0.525 . . . . 74.549999999999997 111.206 178.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.67 -37.3 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 116.16 -0.473 . . . . 74.329999999999998 110.957 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.4 ' HD2' ' HA ' ' A' ' 80' ' ' VAL . 80.8 m-70 -65.11 -28.83 69.71 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 122.339 -0.225 . . . . 70.430000000000007 111.388 177.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.99 -39.62 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.066 0.46 . . . . 51.32 110.994 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.542 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 26.9 m-85 -89.0 26.92 1.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.302 -0.408 . . . . 71.439999999999998 112.034 178.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.8 t -73.86 -12.19 60.6 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.944 0.402 . . . . 75.310000000000002 111.104 175.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -92.06 137.94 31.95 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.242 -0.435 . . . . 72.140000000000001 110.507 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -119.64 37.34 3.16 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 120.525 -0.845 . . . . 73.140000000000001 114.808 -172.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.0 m -121.09 169.98 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-N 117.86 0.83 . . . . 54.149999999999999 111.067 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.9 p -76.09 91.71 3.14 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.325 0.491 . . . . 74.340000000000003 112.325 -177.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -147.57 103.64 3.55 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.494 0.664 . . . . 73.319999999999993 111.682 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -63.17 -11.2 18.92 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.239 -0.437 . . . . 65.349999999999994 112.109 -178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.94 -26.83 55.88 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 121.416 -0.421 . . . . 53.109999999999999 112.998 174.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -62.67 -42.17 99.48 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.054 0.454 . . . . 53.030000000000001 110.369 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 34.9 mm -63.27 -45.26 98.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 CA-C-N 115.896 -0.593 . . . . 72.439999999999998 110.561 177.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.44 -48.41 82.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.982 -0.553 . . . . 72.340000000000003 110.948 176.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.4 m -57.26 -45.66 83.79 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 116.22 -0.446 . . . . 72.329999999999998 111.563 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.542 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 23.8 tp -57.77 -54.94 41.2 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.343 0.592 . . . . 73.040000000000006 111.797 179.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.441 HG22 ' CD2' ' A' ' 16' ' ' TYR . 51.7 mt -71.62 -37.53 63.69 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.864 -0.607 . . . . 71.409999999999997 112.08 -174.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 92.3 p -66.94 -44.08 81.53 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 120.631 0.253 . . . . 42.350000000000001 111.263 179.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -61.48 -40.19 93.64 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.799 0.333 . . . . 53.32 110.717 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.14 -47.61 86.22 Favored Glycine 0 CA--C 1.527 0.811 0 C-N-CA 120.895 -0.669 . . . . 75.049999999999997 112.365 174.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.59 -35.01 79.6 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.098 0.475 . . . . 62.420000000000002 111.5 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.426 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 80.2 t80 -62.01 -45.73 92.29 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.059 -0.519 . . . . 74.519999999999996 111.325 176.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 56.2 t -69.93 -38.39 75.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 120.836 0.351 . . . . 75.540000000000006 110.787 177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.76 69.13 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 112.292 0.479 . . . . 74.030000000000001 112.292 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 104' ' ' PHE . 18.1 ptpt -62.83 -36.55 83.57 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.851 0.357 . . . . 73.340000000000003 111.227 178.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.423 ' O ' HG12 ' A' ' 112' ' ' ILE . 71.7 t60 -65.3 -33.7 76.59 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.909 0.385 . . . . 65.120000000000005 110.33 176.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.504 HD21 ' HB ' ' A' ' 68' ' ' ILE . 89.0 mt -67.41 -50.56 58.96 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.203 -0.453 . . . . 74.439999999999998 111.093 177.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -57.04 -40.57 77.02 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 121.166 0.508 . . . . 63.43 110.477 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 32.8 m -55.97 -48.91 74.95 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.604 -0.725 . . . . 43.219999999999999 111.699 175.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 108' ' ' HIS . 37.1 pt -88.7 22.2 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 N-CA-C 112.142 0.423 . . . . 52.229999999999997 112.142 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 68.32 12.11 8.61 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 112.918 0.71 . . . . 74.400000000000006 112.918 174.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -94.76 38.08 1.12 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.289 0.477 . . . . 71.310000000000002 112.289 -179.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -55.87 -32.27 63.53 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 121.924 -0.485 . . . . 75.030000000000001 110.87 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.7 m -56.9 -29.1 62.71 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.216 -0.447 . . . . 74.329999999999998 111.873 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.474 ' HB2' HD13 ' A' ' 109' ' ' LEU . 44.5 m -76.99 -27.07 54.58 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.485 -0.325 . . . . 55.5 111.706 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 65.9 mt -59.54 -38.47 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 N-CA-C 111.95 0.352 . . . . 73.019999999999996 111.95 -179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.7 -57.17 28.4 Favored Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 112.058 0.392 . . . . 72.129999999999995 112.058 -176.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.74 -26.9 60.22 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 121.669 1.579 . . . . 73.019999999999996 112.367 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.8 tt -63.81 -48.42 76.92 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.706 0.288 . . . . 75.219999999999999 110.235 176.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.39 -40.69 71.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.223 0.535 . . . . 70.420000000000002 111.001 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -67.69 -35.84 79.57 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.928 -0.578 . . . . 64.409999999999997 111.357 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.6 m -63.68 -45.41 90.2 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.731 0.301 . . . . 62.0 111.314 178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.477 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.5 mm -54.84 -50.64 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-O 121.352 0.596 . . . . 73.120000000000005 110.636 175.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 26.7 m -67.93 -33.63 75.06 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.545 -0.752 . . . . 61.149999999999999 111.52 178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.435 ' O ' ' HD3' ' A' ' 131' ' ' ARG . 15.2 t70 -64.02 -52.73 58.14 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.375 -0.375 . . . . 51.299999999999997 110.681 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 98.5 t -62.49 -41.73 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-O 121.149 0.5 . . . . 70.230000000000004 110.821 177.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' ' 137' ' ' LEU . 48.9 tp -54.32 -52.8 60.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.848 -0.614 . . . . 75.230000000000004 111.235 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.479 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 83.2 t -76.02 -27.33 18.06 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 111.9 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 127' ' ' ASP . 0.7 OUTLIER -54.85 -38.12 67.06 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 112.22 0.452 . . . . 75.049999999999997 112.22 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.417 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.5 OUTLIER -130.46 -37.41 1.4 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.154 0.798 . . . . 64.340000000000003 113.154 -175.776 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.417 ' HD2' HG23 ' A' ' 132' ' ' THR . 0.2 OUTLIER -92.5 6.16 48.15 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.971 0.73 . . . . 40.530000000000001 112.971 -177.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 12.7 ttp180 -49.83 -64.44 0.81 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 112.719 0.637 . . . . 74.310000000000002 112.719 -178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -58.09 -34.06 69.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.254 -0.43 . . . . 75.420000000000002 111.924 -178.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . 0.411 ' HD1' ' HA ' ' A' ' 133' ' ' LYS . 50.3 m95 -65.79 -36.52 83.74 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.303 -0.248 . . . . 74.109999999999999 111.222 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.582 ' HB2' HD21 ' A' ' 5' ' ' LEU . 78.5 mt -57.7 -49.01 77.93 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.811 0.338 . . . . 72.0 111.555 175.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.0 p -77.71 -38.02 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 N-CA-C 112.3 0.482 . . . . 73.510000000000005 112.3 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -69.66 -50.31 45.28 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.09 0.404 . . . . 73.450000000000003 112.09 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -85.41 1.8 47.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.69 0.281 . . . . 72.140000000000001 111.342 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 141' ' ' ARG . 23.2 mtp85 51.59 52.75 14.01 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.078 -0.51 . . . . 75.310000000000002 110.919 -175.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -41.89 -58.04 3.28 Favored Glycine 0 CA--C 1.527 0.829 0 N-CA-C 114.994 0.758 . . . . 50.219999999999999 114.994 -174.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -64.25 -20.25 65.92 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 117.512 0.656 . . . . 72.010000000000005 112.629 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -86.52 -57.8 2.86 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.942 0.401 . . . . 74.200000000000003 111.511 172.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.3 -34.73 89.26 Favored Glycine 0 CA--C 1.527 0.812 0 CA-C-N 116.363 -0.38 . . . . 63.240000000000002 114.007 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -58.12 -37.62 74.93 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.091 0.472 . . . . 65.540000000000006 111.708 177.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.669 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.7 t -72.36 -47.81 50.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 116.203 -0.453 . . . . 73.409999999999997 111.928 -177.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -68.51 -28.09 66.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.02 0.438 . . . . 73.400000000000006 111.166 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -55.38 -50.84 68.67 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.022 -0.536 . . . . 64.409999999999997 110.866 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -86.58 -25.97 24.7 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 116.124 -0.489 . . . . 61.509999999999998 111.922 172.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.421 ' HB3' ' NE2' ' A' ' 159' ' ' HIS . 77.8 t60 71.31 106.54 0.06 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.83 0.852 . . . . 61.210000000000001 112.242 -175.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.537 HG12 ' HG2' ' A' ' 153' ' ' GLU . 51.7 t -142.05 -73.89 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 115.977 -0.556 . . . . 73.439999999999998 110.925 177.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.662 ' HB2' ' HB2' ' A' ' 39' ' ' LYS . 22.0 mm-40 -113.32 23.64 13.04 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.098 0.475 . . . . 75.400000000000006 111.534 -177.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.85 134.48 33.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.284 -0.417 . . . . 62.420000000000002 111.418 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.473 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -77.76 -11.08 59.85 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 120.842 0.353 . . . . 71.400000000000006 111.347 176.089 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -68.21 -40.05 82.25 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.878 0.37 . . . . 71.25 111.225 179.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 66.08 58.26 9.23 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.252 -0.431 . . . . 73.019999999999996 113.729 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -163.2 -172.75 31.07 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 120.813 -0.708 . . . . 33.310000000000002 113.473 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . 0.421 ' NE2' ' HB3' ' A' ' 151' ' ' HIS . 66.2 m80 -137.96 93.59 2.79 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.868 0.366 . . . . 71.140000000000001 111.165 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 54.4 t60 -91.99 76.32 5.48 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 121.335 0.588 . . . . 70.25 110.479 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -84.68 95.78 9.01 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 116.307 -0.406 . . . . 75.310000000000002 111.163 -176.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -90.69 123.8 34.58 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.789 0.328 . . . . 45.329999999999998 111.052 177.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 18.4 t60 -142.02 141.58 32.84 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.645 0.26 . . . . 74.129999999999995 110.968 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 60.9 t-80 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.735 -0.65 . . . . 62.549999999999997 111.431 177.903 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ttt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 120.84 0.353 . . . . 60.149999999999999 110.894 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -172.33 178.8 2.71 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.151 -0.477 . . . . 73.019999999999996 111.065 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -83.58 148.31 27.24 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 121.15 0.5 . . . . 74.299999999999997 111.553 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -58.97 -43.28 91.34 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 121.139 0.495 . . . . 74.5 111.481 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.9 tp -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.98 -0.555 . . . . 74.209999999999994 111.084 177.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -62.01 -43.34 99.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.168 -0.469 . . . . 74.010000000000005 110.952 176.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' ARG . 16.5 mmt180 -69.08 -39.43 79.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.472 0.545 . . . . 64.030000000000001 112.472 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -60.84 -49.54 77.08 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.12 0.486 . . . . 71.319999999999993 110.742 175.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.8 m -61.89 -47.31 85.56 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.079 -0.51 . . . . 75.319999999999993 111.117 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.47 -37.8 79.14 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.395 -0.366 . . . . 63.32 111.225 177.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -57.72 -53.68 55.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.332 0.587 . . . . 61.130000000000003 110.763 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.5 mt -63.77 -49.77 80.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.662 -0.699 . . . . 75.230000000000004 111.754 -177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 75.3 mt -63.72 -52.12 61.34 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 112.146 0.425 . . . . 71.239999999999995 112.146 -177.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.6 t -57.17 -48.37 78.89 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-O 120.964 0.411 . . . . 72.140000000000001 111.843 -177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.408 ' NH2' ' O ' ' A' ' 28' ' ' LYS . 57.3 mtp180 -63.4 -40.3 96.84 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.308 -0.405 . . . . 74.140000000000001 111.629 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -60.29 -53.33 58.9 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 120.869 0.366 . . . . 74.319999999999993 111.089 177.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.7 mp -54.92 -39.95 69.34 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 120.743 0.306 . . . . 65.040000000000006 111.293 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -57.22 10.78 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.546 -0.297 . . . . 65.420000000000002 111.662 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -61.48 -32.38 72.38 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.0 0.428 . . . . 72.219999999999999 111.285 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.423 ' HG3' ' HB1' ' A' ' 103' ' ' ALA . 25.4 mm-40 -65.85 -33.98 77.09 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.176 -0.466 . . . . 72.019999999999996 111.852 175.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.98 -41.1 71.45 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.912 0.386 . . . . 71.329999999999998 111.433 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.9 p -86.96 -20.75 26.85 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.004 0.43 . . . . 54.350000000000001 111.84 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.27 26.13 66.8 Favored Glycine 0 CA--C 1.524 0.65 0 C-N-CA 121.294 -0.479 . . . . 75.010000000000005 112.591 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.75 131.8 26.24 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 122.266 0.227 . . . . 63.420000000000002 111.223 -178.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -47.82 146.18 2.5 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 113.589 0.959 . . . . 74.150000000000006 113.589 -177.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.67 170.29 12.61 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-N 115.834 -0.621 . . . . 73.340000000000003 110.97 173.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -151.03 22.46 0.76 Allowed 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.811 0.671 . . . . 74.099999999999994 112.811 -177.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' O ' ' NH2' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -92.08 161.82 32.18 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 122.471 0.308 . . . . 75.540000000000006 111.573 -178.799 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -68.26 148.96 75.4 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 122.559 2.172 . . . . 65.430000000000007 112.053 172.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.475 ' SD ' ' HB3' ' A' ' 37' ' ' SER . 9.2 mmt -90.99 78.5 5.96 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.679 0.992 . . . . 71.219999999999999 113.679 -175.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 32.41 -116.6 0.11 Allowed Glycine 0 CA--C 1.533 1.172 0 CA-C-N 114.97 -1.014 . . . . 71.209999999999994 115.354 176.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.406 ' HG2' ' O ' ' A' ' 32' ' ' ARG . 31.6 ttm180 -117.49 5.09 12.45 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-O 121.282 0.563 . . . . 64.409999999999997 111.361 -178.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.7 m -113.41 -12.44 12.98 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 112.501 0.556 . . . . 43.229999999999997 112.501 -173.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 52.63 -111.98 1.89 Allowed Glycine 0 CA--C 1.534 1.235 0 N-CA-C 114.633 0.613 . . . . 72.140000000000001 114.633 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.79 73.35 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.931 0.715 . . . . 43.219999999999999 112.931 -173.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.0 m -54.29 -51.23 65.27 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.129 0.49 . . . . 73.200000000000003 111.581 -179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.475 ' HB3' ' SD ' ' A' ' 30' ' ' MET . 66.8 m -63.6 -35.5 80.73 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.076 -0.511 . . . . 73.310000000000002 111.981 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.436 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 61.3 ttt180 -66.04 -55.79 14.84 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.83 0.348 . . . . 75.430000000000007 111.066 176.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.506 ' HE2' HG11 ' A' ' 147' ' ' VAL . 59.0 mtpt -55.95 -42.29 75.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.085 -0.507 . . . . 71.129999999999995 111.352 -178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.63 -45.57 91.6 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.319 -0.401 . . . . 61.340000000000003 111.287 174.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 61.6 tp -62.07 -54.85 35.6 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.892 0.377 . . . . 63.340000000000003 111.977 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 38' ' ' ARG . 9.4 pt-20 -66.87 -30.79 71.04 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 111.919 0.34 . . . . 73.230000000000004 111.919 -178.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.552 ' O ' HG22 ' A' ' 47' ' ' VAL . 95.6 m -69.72 -40.91 75.97 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 122.093 -0.38 . . . . 64.129999999999995 110.748 174.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 24.2 mt -53.99 -37.29 63.85 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.217 0.532 . . . . 74.400000000000006 110.595 171.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -68.18 -52.75 30.95 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-N 116.146 -0.479 . . . . 72.099999999999994 111.712 175.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.545 ' NE ' ' HA ' ' A' ' 43' ' ' THR . 3.2 ptp180 -66.24 -21.65 66.3 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.634 0.605 . . . . 61.030000000000001 112.634 -172.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 43' ' ' THR . 23.3 m -110.09 -33.79 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 O-C-N 122.057 -0.402 . . . . 72.209999999999994 111.885 176.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -69.43 -32.57 71.77 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 121.5 -0.381 . . . . 61.450000000000003 113.947 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 28.3 t70 -61.9 -52.15 65.28 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 117.401 0.601 . . . . 74.019999999999996 110.757 178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.41 -41.53 95.27 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 121.47 -0.395 . . . . 65.329999999999998 112.977 176.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.439 ' HA ' HD21 ' A' ' 54' ' ' ASN . 69.8 t -59.89 -49.65 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-O 120.8 0.333 . . . . 74.230000000000004 111.084 175.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.553 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 44.5 mt-30 -57.16 -35.98 70.2 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.585 -0.28 . . . . 52.030000000000001 111.508 177.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 10.4 mmm180 -58.01 -59.76 4.78 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.795 0.331 . . . . 42.149999999999999 111.872 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.439 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.8 p30 -74.93 -19.29 60.19 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 112.095 0.406 . . . . 73.329999999999998 112.095 -176.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.471 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 37.8 m-70 -90.99 -22.81 20.62 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.529 0.566 . . . . 71.530000000000001 112.529 176.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.49 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 30.0 tt0 -54.56 -51.75 64.24 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.787 0.327 . . . . 64.519999999999996 111.818 -176.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -53.37 -29.88 36.76 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.096 0.474 . . . . 73.439999999999998 111.771 178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.48 -53.86 5.93 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.073 0.463 . . . . 73.099999999999994 111.556 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.471 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 15.1 m-85 -58.94 -30.01 67.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.498 0.555 . . . . 74.340000000000003 112.498 -177.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -51.16 -40.98 59.81 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 120.956 0.408 . . . . 75.25 111.404 176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.469 ' HA2' ' CZ ' ' A' ' 64' ' ' ARG . . . -61.96 -28.41 70.31 Favored Glycine 0 CA--C 1.527 0.824 0 C-N-CA 121.203 -0.523 . . . . 75.140000000000001 113.158 178.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 81.1 mtp -89.51 -33.23 16.84 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.378 0.608 . . . . 71.329999999999998 110.335 179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.43 HD22 ' CE2' ' A' ' 104' ' ' PHE . 13.0 tp -63.46 -41.37 98.61 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.744 -0.662 . . . . 62.539999999999999 111.449 -176.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.469 ' CZ ' ' HA2' ' A' ' 61' ' ' GLY . 13.3 ptt180 -67.84 -26.0 65.83 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.267 -0.424 . . . . 74.530000000000001 111.196 176.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -77.14 -32.66 56.5 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.069 0.462 . . . . 73.420000000000002 111.256 175.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 90.2 mt -82.75 -73.13 0.41 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.075 -0.511 . . . . 72.299999999999997 111.531 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.1 t70 45.35 83.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.438 0.637 . . . . 64.5 111.735 -175.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.0 mp -64.95 114.62 2.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 115.9 -0.591 . . . . 64.150000000000006 112.17 -175.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.481 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -103.89 -8.06 19.98 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 111.872 0.323 . . . . 61.130000000000003 111.872 175.389 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.481 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -165.6 170.39 14.28 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.795 0.331 . . . . 60.520000000000003 111.738 175.12 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HG2' ' HE2' ' A' ' 75' ' ' LYS . 42.5 tt0 -57.22 -28.55 62.99 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.315 0.487 . . . . 63.350000000000001 112.315 -177.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -56.98 -39.8 75.32 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 122.183 -0.323 . . . . 70.25 111.768 178.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 33.5 m-20 -60.97 -43.09 99.26 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.499 0.666 . . . . 74.420000000000002 109.742 175.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 121' ' ' LEU . 69.4 t -58.87 -38.29 72.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-N 115.301 -0.863 . . . . 74.340000000000003 111.561 175.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.414 ' HE2' ' HG2' ' A' ' 71' ' ' GLU . 74.5 mmtt -64.7 -40.77 95.94 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.992 0.425 . . . . 71.150000000000006 110.729 176.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.7 t -64.61 -33.82 76.81 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.26 -0.427 . . . . 73.230000000000004 111.136 178.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.5 ' O ' ' HG2' ' A' ' 81' ' ' MET . 88.7 mt -55.82 -33.34 64.37 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.499 -0.319 . . . . 73.510000000000005 111.712 177.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 82' ' ' ILE . 32.3 t -54.7 -39.47 68.19 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.864 0.364 . . . . 73.239999999999995 111.123 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.418 ' O ' ' HD2' ' A' ' 83' ' ' HIS . 23.9 mmt180 -58.86 -47.58 84.39 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.281 -0.418 . . . . 65.230000000000004 111.375 176.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 53.1 t -64.34 -40.71 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 CA-C-O 121.066 0.46 . . . . 75.230000000000004 111.112 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.516 ' HB2' HG21 ' A' ' 128' ' ' VAL . 23.1 mmt -57.82 -40.27 79.59 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.973 -0.558 . . . . 75.349999999999994 111.565 179.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 78' ' ' SER . 75.9 mt -57.78 -37.1 57.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-O 121.081 0.467 . . . . 55.420000000000002 111.085 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.418 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 71.4 m-70 -72.29 -27.51 62.51 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.414 -0.357 . . . . 74.340000000000003 111.631 177.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 84.9 t -57.45 -38.36 62.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-O 120.907 0.384 . . . . 60.219999999999999 111.26 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.446 ' CE2' HD22 ' A' ' 98' ' ' LEU . 39.6 m-85 -83.53 10.51 8.84 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 112.547 0.573 . . . . 74.420000000000002 112.547 178.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.4 t -65.96 -26.65 67.66 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.095 0.474 . . . . 62.299999999999997 110.838 176.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -81.55 111.33 17.76 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 116.109 -0.496 . . . . 63.32 110.626 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.72 47.69 1.3 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 121.263 -0.494 . . . . 42.229999999999997 114.274 -172.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 48.5 t -79.81 -17.08 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 122.285 -0.538 . . . . 54.299999999999997 111.165 176.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 51.1 p 54.22 24.95 5.32 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.101 0.778 . . . . 64.140000000000001 113.101 175.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -84.88 11.18 9.81 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.703 0.631 . . . . 65.530000000000001 112.703 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.3 m95 68.19 -25.89 0.13 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 112.92 0.711 . . . . 73.140000000000001 112.92 -176.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.57 -25.63 55.65 Favored Glycine 0 CA--C 1.528 0.905 0 O-C-N 121.998 -0.439 . . . . 61.32 113.072 176.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.789 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 1.1 mmp_? -62.73 -34.59 77.49 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 122.535 -0.391 . . . . 60.130000000000003 111.275 174.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 37.3 mm -61.93 -45.94 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.207 0.527 . . . . 51.149999999999999 109.876 174.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 42.0 t -57.71 -42.96 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 115.746 -0.661 . . . . 45.130000000000003 110.967 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.4 m -57.7 -48.2 80.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.382 -0.372 . . . . 65.129999999999995 111.137 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.517 ' HG ' HG23 ' A' ' 125' ' ' ILE . 37.3 tp -60.02 -54.39 46.63 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.152 0.501 . . . . 71.319999999999993 111.847 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.6 mt -69.62 -34.19 60.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 CA-C-N 116.284 -0.416 . . . . 63.5 111.921 -175.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.553 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 97.3 p -63.83 -47.37 81.04 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.397 -0.189 . . . . 74.549999999999997 111.437 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 24.5 t80 -59.7 -41.14 90.1 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.797 0.332 . . . . 74.420000000000002 110.833 176.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.64 -45.12 95.14 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 120.872 -0.68 . . . . 73.230000000000004 112.452 175.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.423 ' HB1' ' HG3' ' A' ' 20' ' ' GLN . . . -65.41 -34.6 78.67 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 121.178 0.514 . . . . 72.329999999999998 111.465 177.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.49 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 58.5 t80 -63.13 -48.35 78.88 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.895 -0.593 . . . . 74.439999999999998 111.321 175.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 101' ' ' PHE . 52.7 t -66.76 -37.36 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-N 116.622 -0.263 . . . . 75.540000000000006 110.824 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.38 -44.01 68.29 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.992 0.425 . . . . 64.420000000000002 111.428 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -55.12 -47.4 75.08 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.157 0.503 . . . . 62.109999999999999 110.956 173.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.455 ' O ' HG12 ' A' ' 112' ' ' ILE . 64.8 t60 -65.45 -34.02 77.31 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 111.586 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 86.7 mt -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.52 0.2 . . . . 74.209999999999994 111.084 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -59.27 -41.75 89.59 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.033 0.444 . . . . 62.409999999999997 110.479 175.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 61.1 m -54.05 -45.52 71.69 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 115.92 -0.582 . . . . 64.120000000000005 111.83 177.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -93.63 17.46 1.39 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 112.097 0.406 . . . . 41.310000000000002 112.097 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 71.48 6.62 5.79 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.367 0.877 . . . . 72.340000000000003 113.367 176.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -81.7 45.42 0.89 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.886 0.374 . . . . 74.219999999999999 111.389 176.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -55.54 -43.02 75.4 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 122.994 0.518 . . . . 74.420000000000002 111.573 -176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 83.7 p -62.38 -34.56 76.94 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.418 -0.355 . . . . 71.519999999999996 111.938 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 70.2 m -59.43 -26.0 64.81 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 112.446 0.536 . . . . 75.540000000000006 112.446 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.2 mt -53.87 -39.57 40.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 N-CA-C 112.437 0.532 . . . . 62.200000000000003 112.437 -179.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -68.1 -56.77 10.37 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 112.752 0.649 . . . . 73.120000000000005 112.752 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -56.3 -28.52 72.33 Favored 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 121.714 1.609 . . . . 73.540000000000006 112.289 176.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.487 ' HA ' HG13 ' A' ' 74' ' ' VAL . 6.4 tt -66.3 -46.58 76.47 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 120.958 0.409 . . . . 75.25 110.071 174.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.7 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.252 -0.431 . . . . 62.409999999999997 111.326 175.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -64.17 -47.06 81.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.301 -0.409 . . . . 74.530000000000001 111.079 175.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.5 m -55.81 -44.36 77.79 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 120.873 0.368 . . . . 53.420000000000002 111.23 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.517 HG23 ' HG ' ' A' ' 98' ' ' LEU . 48.9 mm -59.57 -53.5 47.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.172 0.511 . . . . 53.409999999999997 111.136 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.8 m -63.0 -36.09 82.41 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.892 -0.594 . . . . 75.549999999999997 111.584 -179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 28.5 t70 -61.08 -52.32 65.4 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.517 -0.31 . . . . 74.040000000000006 111.389 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.516 HG21 ' HB2' ' A' ' 81' ' ' MET . 61.5 t -64.43 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.187 0.518 . . . . 73.510000000000005 110.972 178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.544 ' HG ' HD11 ' A' ' 137' ' ' LEU . 43.5 tp -55.99 -52.85 62.71 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 115.765 -0.652 . . . . 71.530000000000001 111.067 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.513 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 58.7 t -76.09 -24.26 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-N 115.944 -0.571 . . . . 75.349999999999994 111.512 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 21.9 tpt180 -57.36 -45.55 84.26 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.246 0.461 . . . . 73.439999999999998 112.246 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.436 ' C ' ' HD2' ' A' ' 133' ' ' LYS . 2.4 t -114.86 -30.75 6.33 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.906 1.076 . . . . 65.430000000000007 113.906 -172.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.436 ' HD2' ' C ' ' A' ' 132' ' ' THR . 13.2 mptt -116.88 29.78 7.72 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 113.086 0.773 . . . . 72.200000000000003 113.086 -176.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.513 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 58.2 ttp180 -60.92 -54.6 43.09 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 120.919 0.39 . . . . 75.430000000000007 111.877 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -59.68 -36.74 77.08 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.226 -0.443 . . . . 54.109999999999999 111.542 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -69.71 -36.82 76.24 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 111.752 0.279 . . . . 74.239999999999995 111.752 177.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HG ' ' A' ' 129' ' ' LEU . 38.2 mt -57.47 -44.97 85.3 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 111.721 0.267 . . . . 70.120000000000005 111.721 176.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.0 p -78.25 -43.23 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 N-CA-C 112.364 0.505 . . . . 63.340000000000003 112.364 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -68.59 -36.74 79.12 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.834 0.679 . . . . 74.120000000000005 112.834 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -101.13 3.23 40.99 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.178 -0.327 . . . . 74.510000000000005 111.531 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 31.9 mtm180 49.65 63.97 1.95 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.043 0.449 . . . . 74.549999999999997 110.574 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.09 -47.01 6.46 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 115.114 0.806 . . . . 75.200000000000003 115.114 -171.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 40.5 m95 -75.09 -20.59 59.41 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.676 0.621 . . . . 62.109999999999999 112.676 -175.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -84.44 -51.44 6.93 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.054 0.454 . . . . 75.430000000000007 110.466 170.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.568 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.91 -32.45 66.35 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 115.902 -0.59 . . . . 71.430000000000007 113.012 177.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -58.22 -39.91 80.31 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.148 0.499 . . . . 73.329999999999998 110.983 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.506 HG11 ' HE2' ' A' ' 39' ' ' LYS . 60.4 t -73.16 -40.46 57.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 116.12 -0.491 . . . . 60.009999999999998 111.774 -178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.568 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 13.7 pt-20 -73.39 -33.85 65.22 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 111.897 0.332 . . . . 71.239999999999995 111.897 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -60.53 -45.72 92.81 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 120.986 0.422 . . . . 62.329999999999998 111.603 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -82.3 -9.94 59.29 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 120.821 0.343 . . . . 73.340000000000003 111.311 176.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 54.78 86.71 0.05 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.687 0.756 . . . . 73.450000000000003 111.774 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 74.8 t -94.43 -61.3 2.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.24 -0.891 . . . . 74.219999999999999 111.819 -174.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -108.39 10.92 27.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.303 0.573 . . . . 72.510000000000005 111.21 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.27 124.57 19.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.84 0.681 . . . . 63.140000000000001 112.84 -178.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.448 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -62.62 -21.81 65.94 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.179 -0.464 . . . . 63.32 111.42 173.873 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -75.31 -64.85 0.97 Allowed 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.377 0.608 . . . . 74.0 111.474 178.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 108.87 -147.81 16.79 Favored Glycine 0 CA--C 1.526 0.767 0 CA-C-N 115.655 -0.702 . . . . 43.420000000000002 111.796 -173.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 87.63 124.24 1.96 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.875 -0.678 . . . . 73.430000000000007 113.483 178.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -142.0 146.9 36.1 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 122.428 -0.454 . . . . 64.0 110.74 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -73.46 86.05 1.53 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 120.983 0.421 . . . . 71.400000000000006 111.64 176.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 23.8 p80 -118.14 22.88 11.95 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 121.369 0.604 . . . . 73.420000000000002 110.724 176.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -163.45 102.65 0.94 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.525 -0.761 . . . . 75.519999999999996 110.059 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -120.17 127.7 52.72 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.069 0.462 . . . . 65.25 112.052 -175.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 118.84 -0.6 . . . . 65.329999999999998 111.083 174.78 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.481 ' C ' ' SD ' ' A' ' 1' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.475 0 CA-C-O 120.592 0.234 . . . . 72.299999999999997 110.75 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -66.35 146.99 53.96 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.298 0.571 . . . . 75.319999999999993 112.211 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -91.07 146.0 24.22 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.943 -0.571 . . . . 75.010000000000005 110.294 170.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -51.4 -38.35 53.04 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 121.465 0.65 . . . . 65.549999999999997 111.055 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.436 HD21 ' CB ' ' A' ' 137' ' ' LEU . 63.3 tp -68.82 -35.79 77.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.404 -0.816 . . . . 54.409999999999997 112.13 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -69.8 -43.85 71.24 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.981 0.419 . . . . 73.239999999999995 110.175 -177.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 6.7 mmp_? -59.62 -51.69 68.75 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.048 -0.524 . . . . 61.0 111.418 176.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -61.57 -52.2 65.41 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 120.73 0.3 . . . . 61.210000000000001 111.75 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.4 m -56.33 -45.48 80.32 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.684 0.278 . . . . 75.219999999999999 111.098 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.1 tp -60.66 -41.51 95.19 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.701 0.286 . . . . 75.519999999999996 111.279 176.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -60.58 -48.49 81.53 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.039 0.447 . . . . 71.519999999999996 110.748 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.569 HG12 ' HE3' ' A' ' 30' ' ' MET . 69.5 mt -60.77 -54.12 39.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 CA-C-O 121.109 0.48 . . . . 74.340000000000003 111.616 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.476 ' O ' HD13 ' A' ' 17' ' ' LEU . 88.8 mt -61.21 -52.02 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.034 -0.53 . . . . 71.239999999999995 111.68 -178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.8 t -53.58 -47.53 70.03 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.824 0.345 . . . . 71.430000000000007 111.197 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 11.1 mtp180 -56.2 -55.62 30.9 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.379 -0.373 . . . . 51.409999999999997 111.568 176.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -54.83 -43.78 73.32 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.674 0.274 . . . . 75.540000000000006 111.473 -177.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.528 ' HG ' ' HA ' ' A' ' 103' ' ' ALA . 10.8 mp -59.95 -43.54 94.96 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.756 0.313 . . . . 64.019999999999996 111.204 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -64.65 -50.41 67.2 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.798 0.333 . . . . 64.140000000000001 111.619 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 15' ' ' ARG . 25.9 mt-10 -60.44 -38.63 84.75 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.056 0.455 . . . . 62.210000000000001 111.388 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 29.0 mm-40 -69.83 -46.1 66.38 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.312 -0.403 . . . . 73.319999999999993 111.889 176.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.7 81.22 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.1 0.407 . . . . 71.549999999999997 112.1 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 81.7 p -87.45 -28.22 22.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 120.707 0.289 . . . . 60.399999999999999 111.77 -178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.26 35.14 27.53 Favored Glycine 0 CA--C 1.526 0.764 0 C-N-CA 121.082 -0.58 . . . . 53.32 112.682 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -152.46 -173.19 4.47 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.403 0.281 . . . . 65.420000000000002 110.933 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -97.78 142.94 28.93 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.114 0.483 . . . . 74.450000000000003 111.542 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -100.64 167.57 10.25 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.926 -0.579 . . . . 62.109999999999999 110.666 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.9 t -141.87 33.08 1.58 Allowed 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.378 0.609 . . . . 73.310000000000002 112.056 -177.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -73.65 139.04 77.27 Favored Pre-proline 0 N--CA 1.473 0.708 0 O-C-N 122.105 -0.372 . . . . 64.409999999999997 111.257 175.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -53.89 122.63 11.71 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 122.851 2.367 . . . . 71.219999999999999 112.777 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.569 ' HE3' HG12 ' A' ' 12' ' ' ILE . 3.5 tpt -75.68 169.79 17.44 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 112.779 0.659 . . . . 64.150000000000006 112.779 -171.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.39 -174.21 18.98 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 114.958 0.743 . . . . 51.5 114.958 -174.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.508 ' HD3' ' N ' ' A' ' 33' ' ' SER . 0.1 OUTLIER -53.12 -43.91 67.26 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 113.275 0.843 . . . . 64.340000000000003 113.275 -175.093 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.508 ' N ' ' HD3' ' A' ' 32' ' ' ARG . 74.6 m -86.37 93.29 9.07 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.927 -0.483 . . . . 64.040000000000006 110.554 174.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -58.67 -68.19 1.81 Allowed Glycine 0 CA--C 1.526 0.771 0 CA-C-N 116.363 -0.381 . . . . 72.200000000000003 113.718 -175.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -49.21 71.15 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 111.842 0.312 . . . . 71.230000000000004 111.842 -179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 33' ' ' SER . 77.7 m -54.63 -46.81 73.98 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-O 120.745 0.307 . . . . 72.340000000000003 111.806 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 71.7 m -65.02 -35.63 81.8 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.633 0.254 . . . . 63.420000000000002 111.579 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.452 ' NH1' ' HB3' ' A' ' 42' ' ' GLU . 18.1 tpt85 -64.81 -50.47 66.61 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.818 0.342 . . . . 61.149999999999999 110.663 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.497 ' HE3' ' HB3' ' A' ' 153' ' ' GLU . 54.4 mtpt -59.69 -43.63 93.98 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.809 -0.632 . . . . 72.420000000000002 111.35 178.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.14 81.84 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.97 0.414 . . . . 73.420000000000002 111.215 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HG ' HH21 ' A' ' 45' ' ' ARG . 49.0 tp -61.49 -36.76 81.38 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.277 -0.419 . . . . 63.020000000000003 111.852 -178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HB3' ' NH1' ' A' ' 38' ' ' ARG . 15.8 pt-20 -78.99 -37.8 38.35 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 122.134 -0.354 . . . . 75.450000000000003 111.137 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.526 HG23 HG21 ' A' ' 152' ' ' VAL . 95.4 m -63.12 -35.23 79.58 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.893 0.378 . . . . 74.299999999999997 110.808 175.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.0 mt -56.81 -32.76 66.04 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.983 0.421 . . . . 61.310000000000002 111.161 172.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.439 HH22 ' CD ' ' A' ' 19' ' ' GLU . 32.2 mtt-85 -79.07 -43.72 23.59 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.078 0.466 . . . . 75.230000000000004 110.415 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.88 -44.8 59.84 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.588 -0.733 . . . . 75.510000000000005 112.324 -179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 34.0 m -106.81 -34.49 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 112.267 0.469 . . . . 71.019999999999996 112.267 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.78 -39.64 97.73 Favored Glycine 0 CA--C 1.524 0.644 0 C-N-CA 121.28 -0.486 . . . . 61.509999999999998 113.473 -177.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.35 -56.33 23.42 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.936 0.398 . . . . 74.319999999999993 110.974 177.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -56.38 -48.17 77.59 Favored Glycine 0 CA--C 1.525 0.704 0 CA-C-N 116.034 -0.53 . . . . 73.420000000000002 112.797 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 47' ' ' VAL . 74.4 t -57.45 -50.86 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 O-C-N 122.851 -0.205 . . . . 75.129999999999995 111.216 179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -53.84 -46.91 71.34 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.689 0.255 . . . . 72.510000000000005 111.689 177.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -60.86 -45.69 93.55 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.857 0.688 . . . . 71.019999999999996 112.857 -176.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -84.76 -21.2 30.08 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.692 -0.63 . . . . 54.109999999999999 112.052 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -90.4 -18.29 25.71 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 112.322 0.489 . . . . 74.530000000000001 112.322 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 40.6 tt0 -49.07 -46.04 43.91 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 112.558 0.577 . . . . 74.340000000000003 112.558 -174.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 3.2 t -56.17 -35.28 67.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.907 0.384 . . . . 32.420000000000002 111.965 177.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.57 -44.01 21.9 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.811 0.338 . . . . 72.239999999999995 111.737 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -59.9 -47.33 86.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.605 -0.27 . . . . 64.329999999999998 111.35 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.483 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 75.4 mm-40 -53.15 -38.19 62.49 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.87 0.367 . . . . 61.219999999999999 111.028 176.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.24 -41.21 86.31 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 121.03 -0.605 . . . . 64.439999999999998 112.313 175.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 39.9 mtm -72.78 -34.13 66.73 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.483 -0.422 . . . . 72.510000000000005 111.148 176.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -61.0 -33.62 73.54 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.647 0.261 . . . . 75.140000000000001 110.916 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 47.3 mtm180 -68.83 -17.3 63.98 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.156 0.503 . . . . 70.209999999999994 111.239 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -95.6 -20.35 19.04 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.961 -0.563 . . . . 72.239999999999995 110.917 173.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.6 mt -99.83 -82.38 0.45 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.06 -0.518 . . . . 51.109999999999999 111.865 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.7 t0 48.63 98.94 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.702 0.763 . . . . 63.210000000000001 111.97 -172.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.459 ' N ' HD12 ' A' ' 68' ' ' ILE . 1.6 mp -76.32 123.81 33.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 115.614 -0.721 . . . . 74.0 111.904 -175.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -113.25 -5.55 13.63 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.22 0.452 . . . . 52.43 112.22 177.148 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.417 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -167.35 174.14 8.28 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.924 0.392 . . . . 71.430000000000007 111.625 173.379 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -52.08 -38.91 58.79 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.434 0.531 . . . . 74.150000000000006 112.434 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -51.3 -41.79 60.74 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 112.241 0.459 . . . . 75.239999999999995 112.241 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.451 ' HB2' HG23 ' A' ' 68' ' ' ILE . 20.5 m-20 -63.21 -43.11 99.04 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.889 0.376 . . . . 70.400000000000006 110.647 179.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.527 HG21 ' HB3' ' A' ' 117' ' ' SER . 72.6 t -56.38 -43.43 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 115.92 -0.582 . . . . 73.349999999999994 110.993 177.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -73.07 -29.38 62.91 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.186 -0.461 . . . . 64.439999999999998 111.511 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 49.8 m -68.39 -28.67 67.31 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.933 0.397 . . . . 41.420000000000002 110.851 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 73' ' ' ASP . 86.7 mt -55.67 -28.38 55.18 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 116.339 -0.391 . . . . 74.209999999999994 111.452 176.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 82' ' ' ILE . 81.3 p -52.13 -35.27 47.85 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 120.798 0.333 . . . . 74.120000000000005 111.373 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.7 mmt-85 -61.75 -45.55 93.42 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.99 0.424 . . . . 52.450000000000003 110.713 178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 82.4 t -64.16 -42.79 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-O 121.141 0.496 . . . . 74.030000000000001 110.354 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.472 ' SD ' HD12 ' A' ' 98' ' ' LEU . 21.7 mmt -56.17 -38.93 71.59 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.709 -0.678 . . . . 70.420000000000002 111.673 179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 78' ' ' SER . 85.0 mt -64.37 -41.24 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.098 0.475 . . . . 74.140000000000001 110.911 174.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -64.73 -27.93 69.24 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 112.046 0.388 . . . . 65.340000000000003 112.046 178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.0 t -55.28 -34.63 33.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 121.016 0.436 . . . . 44.329999999999998 111.911 178.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -79.82 42.45 0.54 Allowed 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 112.057 0.392 . . . . 73.420000000000002 112.057 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.3 t -129.64 36.05 4.13 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.133 0.492 . . . . 75.209999999999994 111.521 -175.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.514 ' OD1' ' HB3' ' A' ' 94' ' ' ARG . 1.5 m-20 -57.91 -28.82 64.58 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.793 0.664 . . . . 64.219999999999999 112.793 -177.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 90.79 -10.08 75.85 Favored Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.058 -0.591 . . . . 64.549999999999997 111.994 -171.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.8 m -139.61 136.97 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 123.387 0.675 . . . . 62.310000000000002 110.261 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 t -75.15 96.26 3.24 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.637 0.732 . . . . 71.230000000000004 111.552 -177.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.8 p30 -132.15 -172.55 2.91 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.862 -0.608 . . . . 63.210000000000001 111.443 -176.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.439 ' HE3' HG13 ' A' ' 95' ' ' ILE . 79.4 m95 -102.09 3.62 38.82 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 120.964 0.411 . . . . 73.519999999999996 110.701 171.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -62.64 -41.36 99.83 Favored Glycine 0 CA--C 1.525 0.697 0 CA-C-N 116.311 -0.404 . . . . 71.340000000000003 112.589 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.514 ' HB3' ' OD1' ' A' ' 87' ' ' ASP . 19.6 ptt180 -51.77 -38.14 54.27 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.901 0.381 . . . . 75.019999999999996 111.636 171.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.439 HG13 ' HE3' ' A' ' 92' ' ' TRP . 36.9 mm -69.6 -43.21 80.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.987 0.423 . . . . 63.420000000000002 110.561 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 48.1 t -57.69 -53.19 48.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 CA-C-N 116.199 -0.455 . . . . 74.140000000000001 111.029 175.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.9 m -57.79 -45.0 86.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 116.226 -0.443 . . . . 64.0 111.504 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 26.7 tp -57.33 -54.63 44.61 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.167 0.508 . . . . 54.240000000000002 111.631 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.84 -41.94 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.236 -0.438 . . . . 74.540000000000006 111.739 -178.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.9 m -63.02 -41.18 99.48 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 120.674 0.273 . . . . 53.229999999999997 111.391 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.433 ' O ' HG23 ' A' ' 105' ' ' VAL . 29.5 t80 -68.89 -40.15 79.36 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.681 0.277 . . . . 74.140000000000001 110.742 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.17 -48.01 83.24 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 120.834 -0.698 . . . . 23.219999999999999 112.221 174.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.528 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.9 -35.13 80.14 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.136 0.494 . . . . 62.200000000000003 111.374 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.416 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 44.2 t80 -61.83 -50.89 70.46 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.905 -0.588 . . . . 73.150000000000006 110.919 177.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 101' ' ' PHE . 59.3 t -62.33 -38.54 81.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 116.33 -0.395 . . . . 73.409999999999997 110.815 177.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.33 -41.01 71.89 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.871 0.367 . . . . 43.539999999999999 111.618 176.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 95.8 mttt -58.06 -44.87 87.74 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.057 0.456 . . . . 71.049999999999997 111.046 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.407 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.4 t60 -67.64 -36.46 80.83 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 116.346 -0.388 . . . . 75.540000000000006 111.163 177.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.7 mt -63.48 -50.36 69.96 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.611 0.243 . . . . 72.530000000000001 111.556 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -60.92 -40.83 94.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.047 0.451 . . . . 63.240000000000002 110.712 178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 98.1 m -58.81 -39.13 80.26 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.154 -0.475 . . . . 75.140000000000001 112.239 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.407 HG12 ' O ' ' A' ' 108' ' ' HIS . 38.5 pt -94.55 17.2 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 N-CA-C 112.654 0.613 . . . . 71.340000000000003 112.654 -178.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 71.74 12.59 6.28 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 112.747 0.647 . . . . 63.039999999999999 112.747 178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -97.95 31.65 2.62 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.781 0.324 . . . . 74.140000000000001 111.347 176.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.446 ' HG3' HD12 ' A' ' 118' ' ' ILE . 38.4 tt0 -56.74 -35.64 68.84 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.196 0.443 . . . . 61.310000000000002 112.196 -178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.7 m -56.56 -27.51 57.93 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.026 0.441 . . . . 73.420000000000002 111.576 178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.527 ' HB3' HG21 ' A' ' 74' ' ' VAL . 53.4 m -71.26 -25.82 62.63 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.405 0.521 . . . . 62.119999999999997 112.405 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.446 HD12 ' HG3' ' A' ' 115' ' ' GLU . 72.6 mt -53.59 -46.74 60.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 113.08 0.77 . . . . 75.120000000000005 113.08 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -65.58 -54.08 32.83 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 112.497 0.555 . . . . 63.299999999999997 112.497 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.19 -26.44 69.64 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.575 1.516 . . . . 71.400000000000006 112.492 174.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.425 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.4 tt -67.36 -44.65 78.46 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 109.717 -0.475 . . . . 74.530000000000001 109.717 173.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.466 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.16 -37.79 78.18 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.074 0.464 . . . . 71.430000000000007 111.099 174.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.14 -38.64 91.27 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.116 -0.493 . . . . 73.409999999999997 110.682 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.0 m -63.05 -44.17 96.58 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 120.815 0.341 . . . . 63.350000000000001 111.136 175.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 47.5 mm -56.34 -53.04 44.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.179 0.514 . . . . 71.010000000000005 110.656 176.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -63.7 -35.77 81.67 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.737 -0.665 . . . . 74.219999999999999 111.55 179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 27.0 t70 -62.88 -52.06 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.539 -0.3 . . . . 71.349999999999994 111.396 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 65.0 t -62.23 -46.15 97.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 121.163 0.506 . . . . 73.349999999999994 110.442 176.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.7 tp -49.94 -53.07 28.53 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.526 -0.761 . . . . 65.530000000000001 111.673 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.504 HG13 ' HD3' ' A' ' 134' ' ' ARG . 71.2 t -76.92 -32.94 20.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 115.912 -0.586 . . . . 74.409999999999997 112.166 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 16.0 tpt180 -55.26 -33.13 62.92 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 121.008 0.432 . . . . 60.439999999999998 111.738 -176.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -40.73 3.35 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.672 0.619 . . . . 64.209999999999994 112.672 -178.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -101.9 18.94 19.32 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.48 0.918 . . . . 71.400000000000006 113.48 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.504 ' HD3' HG13 ' A' ' 130' ' ' VAL . 14.8 tpt180 -47.28 -56.37 6.91 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 112.591 0.589 . . . . 73.109999999999999 112.591 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.35 -42.8 58.78 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.824 0.345 . . . . 70.430000000000007 111.069 -177.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -56.43 -37.37 70.13 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.503 -0.317 . . . . 70.219999999999999 111.824 178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.558 HD11 ' HG ' ' A' ' 129' ' ' LEU . 18.4 mt -55.05 -51.17 67.16 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 116.421 -0.354 . . . . 72.299999999999997 111.924 178.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.1 p -77.78 -43.06 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 O-C-N 121.631 -0.668 . . . . 70.219999999999999 112.071 178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -58.72 -40.59 84.18 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 112.233 0.457 . . . . 73.150000000000006 112.233 -177.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -101.66 10.85 39.75 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.27 0.557 . . . . 72.209999999999994 110.7 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.631 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 23.0 mtm180 67.17 7.21 5.28 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.349 -0.841 . . . . 75.019999999999996 113.088 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' 137' ' ' LEU . . . 32.21 -82.65 0.0 OUTLIER Glycine 0 N--CA 1.468 0.827 0 N-CA-C 115.711 1.045 . . . . 73.140000000000001 115.711 173.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.442 ' O ' HG23 ' A' ' 147' ' ' VAL . 40.2 m95 -70.87 -46.48 62.56 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.341 0.256 . . . . 72.430000000000007 111.382 -176.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.631 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 23.7 m-20 -61.85 -39.94 93.59 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.056 0.455 . . . . 73.099999999999994 110.025 170.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -61.34 -35.55 91.14 Favored Glycine 0 CA--C 1.525 0.683 0 CA-C-N 115.85 -0.614 . . . . 63.299999999999997 112.503 176.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 33.6 t80 -67.14 -44.19 80.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 123.074 0.55 . . . . 64.299999999999997 111.111 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 143' ' ' TRP . 94.8 t -62.96 -44.29 99.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 CA-C-N 116.199 -0.455 . . . . 64.430000000000007 111.898 178.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -73.58 -32.07 63.94 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.675 0.274 . . . . 71.329999999999998 111.738 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -55.82 -50.42 70.58 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.954 0.407 . . . . 71.120000000000005 111.79 -177.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.18 -14.02 45.27 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.225 -0.443 . . . . 72.450000000000003 112.098 174.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.62 ' HB2' ' HB3' ' A' ' 159' ' ' HIS . 26.9 t-80 57.61 79.23 0.2 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.198 0.599 . . . . 72.030000000000001 111.569 -173.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.526 HG21 HG23 ' A' ' 43' ' ' THR . 93.1 t -107.09 -68.52 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.858 -0.61 . . . . 70.120000000000005 110.334 176.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.497 ' HB3' ' HE3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -105.77 67.27 0.75 Allowed 'General case' 0 CA--C 1.541 0.63 0 CA-C-O 121.543 0.687 . . . . 72.519999999999996 110.44 179.7 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.446 ' HB3' ' HD2' ' A' ' 151' ' ' HIS . 12.7 t70 -143.68 151.51 40.16 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.646 -0.706 . . . . 74.319999999999993 111.116 178.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.484 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -99.68 -23.54 15.0 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 113.239 0.829 . . . . 74.040000000000006 113.239 -174.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -81.59 -52.62 7.02 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.444 0.535 . . . . 71.409999999999997 112.444 -176.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 133.09 -103.92 0.52 Allowed Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 75.209999999999994 113.546 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 65.41 -110.29 3.4 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 121.464 -0.398 . . . . 72.219999999999999 113.638 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . 0.62 ' HB3' ' HB2' ' A' ' 151' ' ' HIS . 12.2 p-80 58.38 130.16 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.629 1.172 . . . . 64.120000000000005 113.218 -179.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -160.04 131.33 5.89 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.627 -0.715 . . . . 75.439999999999998 110.829 -179.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -155.37 134.44 12.22 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.812 0.671 . . . . 73.420000000000002 112.812 -178.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 22.1 p-80 -141.46 153.52 45.02 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 116.344 -0.389 . . . . 72.230000000000004 110.325 172.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 15.0 p80 -136.41 -179.88 5.95 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.691 0.626 . . . . 72.439999999999998 112.691 -170.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 118.641 -0.695 . . . . 63.32 111.278 177.99 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 120.867 0.365 . . . . 61.310000000000002 111.395 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.48 156.57 22.37 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-O 121.356 0.598 . . . . 64.129999999999995 112.256 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.43 163.94 24.39 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.633 0.605 . . . . 62.030000000000001 112.633 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.08 -40.01 60.57 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.532 0.682 . . . . 72.019999999999996 110.5 173.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.8 tp -58.05 -38.7 76.79 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 115.487 -0.779 . . . . 71.310000000000002 111.692 176.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -67.53 -41.18 84.77 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.522 -0.308 . . . . 73.219999999999999 110.581 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -53.94 -51.45 63.78 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.769 0.318 . . . . 65.439999999999998 111.439 176.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.68 -52.73 59.35 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.056 0.391 . . . . 63.310000000000002 112.056 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 p -57.83 -43.17 85.64 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 116.283 -0.417 . . . . 73.030000000000001 111.389 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.429 HD11 ' HG2' ' A' ' 123' ' ' GLU . 36.3 tp -62.21 -41.78 98.69 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.55 -0.296 . . . . 64.040000000000006 111.673 177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -59.25 -51.61 69.22 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.897 0.379 . . . . 64.239999999999995 111.412 177.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.89 -52.51 48.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.201 0.524 . . . . 74.439999999999998 111.486 -179.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 72.0 mt -67.18 -42.39 88.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-N 115.921 -0.581 . . . . 74.299999999999997 111.825 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 t -59.62 -49.59 77.18 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.63 0.252 . . . . 64.450000000000003 111.587 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.461 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 67.1 mtt180 -59.23 -48.1 82.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.871 0.367 . . . . 62.5 110.685 177.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -56.82 -54.96 40.37 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.257 -0.429 . . . . 74.109999999999999 112.055 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.34 -40.21 81.55 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.791 0.293 . . . . 74.329999999999998 111.791 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 20.7 mmm180 -63.47 -57.5 10.05 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 111.907 0.336 . . . . 74.150000000000006 111.907 178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.2 mm-40 -66.66 -31.32 71.93 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.937 0.399 . . . . 72.340000000000003 111.828 -177.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -76.36 -34.48 58.92 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.632 0.253 . . . . 73.239999999999995 111.423 179.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.93 -34.54 71.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.168 0.509 . . . . 43.25 110.982 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.3 p -86.95 -22.33 25.68 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.08 -0.509 . . . . 75.430000000000007 111.794 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.98 38.5 48.28 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 121.319 -0.467 . . . . 55.130000000000003 112.712 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -140.3 -161.9 1.27 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.143 0.497 . . . . 70.400000000000006 111.909 -176.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -148.76 128.5 13.32 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 116.209 -0.45 . . . . 74.25 110.903 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -88.02 176.33 7.36 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.038 0.447 . . . . 73.140000000000001 111.139 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -130.99 26.31 4.93 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.104 0.478 . . . . 61.039999999999999 111.505 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 38.2 mtmm -71.46 137.93 83.65 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-O 120.8 0.333 . . . . 73.310000000000002 111.708 -178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.0 134.6 64.6 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 122.552 2.168 . . . . 73.030000000000001 111.879 176.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.0 tpt -73.0 153.6 40.85 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.899 0.38 . . . . 64.349999999999994 111.327 -175.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -64.76 -167.32 1.44 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 115.33 0.892 . . . . 71.049999999999997 115.33 -174.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.0 ttt180 -53.48 -30.44 40.97 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.861 1.06 . . . . 75.010000000000005 113.861 -173.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.471 ' OG ' ' HB2' ' A' ' 37' ' ' SER . 85.7 p -79.84 -12.42 59.76 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.287 0.477 . . . . 64.219999999999999 112.287 -177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 61.48 -116.39 9.28 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-N 116.161 -0.472 . . . . 55.130000000000003 113.505 176.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.89 -38.35 70.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.464 0.542 . . . . 54.329999999999998 112.464 -177.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.485 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 25.1 m -58.98 -48.07 82.87 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.971 0.415 . . . . 73.030000000000001 111.82 -176.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.471 ' HB2' ' OG ' ' A' ' 33' ' ' SER . 35.4 t -64.88 -43.14 93.9 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.972 0.415 . . . . 70.109999999999999 111.065 177.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.2 tpt180 -60.84 -54.7 41.96 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 116.267 -0.424 . . . . 65.239999999999995 112.142 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.485 ' HD3' ' HA ' ' A' ' 36' ' ' THR . 20.8 ptmt -56.03 -41.85 75.61 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 120.559 0.218 . . . . 74.010000000000005 111.054 -178.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.27 -47.05 87.77 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.766 0.317 . . . . 73.140000000000001 111.524 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.4 tp -58.85 -54.7 44.18 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.524 0.565 . . . . 64.0 112.524 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.05 -27.75 63.87 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.105 -0.372 . . . . 64.420000000000002 111.756 -176.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.492 ' O ' HG22 ' A' ' 47' ' ' VAL . 46.8 m -62.75 -45.19 93.86 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 120.827 0.346 . . . . 73.349999999999994 110.135 171.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.8 mt -54.57 -34.65 62.24 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.29 -0.414 . . . . 73.519999999999996 111.719 175.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 13.9 mtp180 -70.73 -52.21 22.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.785 0.326 . . . . 72.409999999999997 110.945 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.5 ttm180 -58.85 -44.27 90.95 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.15 -0.477 . . . . 74.129999999999995 112.164 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 43' ' ' THR . 19.5 m -87.98 -33.05 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-O 120.948 0.404 . . . . 72.010000000000005 111.942 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.02 -30.34 74.0 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 114.229 0.451 . . . . 61.119999999999997 114.229 -174.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.521 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 29.6 t70 -58.42 -57.61 12.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 117.568 0.684 . . . . 75.209999999999994 111.277 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -60.07 -42.08 98.3 Favored Glycine 0 CA--C 1.526 0.763 0 C-N-CA 121.353 -0.451 . . . . 55.200000000000003 113.006 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 47' ' ' VAL . 77.0 t -57.52 -45.47 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 O-C-N 122.593 -0.357 . . . . 73.150000000000006 111.067 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -61.27 -43.86 98.19 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.76 -0.2 . . . . 72.5 111.22 175.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 4.3 mmp_? -57.25 -49.4 76.16 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.826 0.346 . . . . 75.239999999999995 111.494 178.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -66.17 -47.65 73.29 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.155 0.502 . . . . 64.200000000000003 111.637 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 13.0 m170 -73.05 -20.69 60.93 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.943 -0.571 . . . . 71.140000000000001 112.453 -176.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -49.1 -54.59 15.41 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.324 0.491 . . . . 74.209999999999994 112.324 -175.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.1 t -53.24 -36.73 61.39 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.419 0.525 . . . . 75.329999999999998 112.419 178.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -76.55 -50.08 14.81 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.014 0.435 . . . . 53.310000000000002 111.538 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 21.5 m-30 -60.04 -36.57 77.57 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.342 -0.39 . . . . 73.120000000000005 111.882 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.532 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 70.7 mm-40 -47.13 -50.99 19.17 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-O 120.985 0.421 . . . . 53.240000000000002 111.254 176.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -56.78 -35.47 67.98 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 116.098 -0.501 . . . . 75.439999999999998 113.208 179.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 45.0 mtm -77.15 -44.59 29.75 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 122.301 -0.529 . . . . 60.240000000000002 111.143 179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 105' ' ' VAL . 9.1 mp -54.88 -27.73 44.96 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.132 -0.355 . . . . 72.109999999999999 111.416 176.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 99.4 mtt180 -65.02 -44.72 88.24 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.749 0.309 . . . . 73.239999999999995 111.562 174.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.69 -7.07 55.42 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.344 0.498 . . . . 70.340000000000003 112.344 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.404 HD13 HD21 ' A' ' 77' ' ' LEU . 96.1 mt -96.35 -71.66 0.67 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.052 0.453 . . . . 74.040000000000006 111.209 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t0 47.46 88.85 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.248 -0.887 . . . . 72.319999999999993 111.838 -172.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.523 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -73.22 103.09 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 115.914 -0.584 . . . . 55.140000000000001 111.053 -178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.428 ' HD3' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.09 -11.3 16.66 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.101 0.408 . . . . 75.030000000000001 112.101 -179.294 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.428 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . 1.2 p30 -154.42 176.79 11.91 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-O 121.024 0.44 . . . . 72.519999999999996 111.978 178.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -58.1 -39.72 79.36 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 116.163 -0.471 . . . . 74.120000000000005 112.119 -178.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -56.1 -39.87 72.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.483 -0.326 . . . . 73.040000000000006 111.747 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.523 ' HB2' HG23 ' A' ' 68' ' ' ILE . 50.8 m-20 -62.23 -39.12 91.76 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.938 0.399 . . . . 73.409999999999997 110.711 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.426 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 82.2 t -60.87 -46.8 95.67 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 121.206 0.526 . . . . 65.349999999999994 110.927 175.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' SER . 99.7 mttt -65.91 -28.78 69.19 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.889 0.376 . . . . 61.140000000000001 111.186 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.9 m -67.55 -36.48 81.04 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.791 0.329 . . . . 51.119999999999997 110.492 171.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.54 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.7 mt -59.44 -39.98 85.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.668 0.27 . . . . 74.219999999999999 110.617 173.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' LYS . 28.9 t -52.46 -37.02 56.07 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.96 0.409 . . . . 43.229999999999997 111.225 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 mmm180 -61.37 -47.27 86.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 120.947 0.403 . . . . 64.150000000000006 110.361 176.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.456 ' O ' HG23 ' A' ' 84' ' ' VAL . 59.7 t -60.89 -42.86 94.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 CA-C-N 116.263 -0.426 . . . . 75.310000000000002 110.892 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.1 mmt -54.54 -44.14 72.57 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.131 -0.486 . . . . 64.450000000000003 111.238 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 78' ' ' SER . 74.9 mt -61.79 -36.9 76.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.146 0.498 . . . . 64.120000000000005 111.137 176.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.456 ' HA ' ' OG ' ' A' ' 86' ' ' SER . 82.6 m-70 -71.65 -27.47 63.1 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.073 0.397 . . . . 64.530000000000001 112.073 178.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 80' ' ' VAL . 94.1 t -58.82 -23.84 24.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 N-CA-C 111.994 0.368 . . . . 73.25 111.994 178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.469 ' CE2' HD22 ' A' ' 98' ' ' LEU . 58.0 m-85 -106.5 9.44 31.59 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 112.437 0.532 . . . . 62.130000000000003 112.437 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.456 ' OG ' ' HA ' ' A' ' 83' ' ' HIS . 59.2 m -73.52 -5.13 38.22 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.034 0.445 . . . . 70.239999999999995 111.863 -178.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -65.54 -26.08 67.72 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.393 -0.367 . . . . 61.399999999999999 111.986 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 79.33 1.86 86.63 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 121.274 -0.489 . . . . 32.350000000000001 114.012 178.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.0 m -80.77 159.46 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 O-C-N 122.409 -0.465 . . . . 73.230000000000004 111.851 -178.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 62.1 p -95.17 -4.1 46.64 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 112.2 0.445 . . . . 62.100000000000001 112.2 -178.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 34.9 m-20 -56.71 118.97 5.4 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.563 0.579 . . . . 72.409999999999997 112.563 -175.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -67.12 -19.42 65.62 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.285 0.476 . . . . 74.409999999999997 112.285 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.47 -27.81 54.61 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 120.978 -0.63 . . . . 70.239999999999995 113.506 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.9 mtp85 -65.8 -25.64 67.33 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 122.52 -0.4 . . . . 74.439999999999998 112.0 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.4 mm -57.03 -40.75 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 121.247 0.546 . . . . 71.430000000000007 110.16 174.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.42 -41.45 88.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 116.031 -0.531 . . . . 64.319999999999993 110.886 176.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 89.6 m -57.86 -44.26 86.48 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 120.859 0.361 . . . . 64.040000000000006 111.233 177.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.469 HD22 ' CE2' ' A' ' 85' ' ' PHE . 31.5 tp -61.39 -54.94 37.19 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 121.184 0.516 . . . . 70.109999999999999 111.693 178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.4 mt -68.37 -37.01 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.136 -0.484 . . . . 75.099999999999994 112.193 -176.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.6 p -64.05 -41.88 97.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.653 -0.249 . . . . 72.450000000000003 111.282 179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 16.0 t80 -60.17 -43.48 95.81 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.921 0.391 . . . . 62.109999999999999 110.577 175.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.72 -46.42 92.26 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.969 -0.634 . . . . 51.310000000000002 112.552 174.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.13 80.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.941 0.401 . . . . 71.329999999999998 111.682 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -65.59 -47.98 73.9 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.267 -0.424 . . . . 70.040000000000006 111.025 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.48 HG23 ' O ' ' A' ' 101' ' ' PHE . 41.6 t -64.92 -34.24 69.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-O 120.93 0.395 . . . . 74.329999999999998 110.546 176.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.09 -39.91 79.79 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.134 -0.485 . . . . 65.530000000000001 111.405 176.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -57.25 -46.2 83.26 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.15 0.5 . . . . 72.239999999999995 110.906 174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -62.3 -35.8 80.14 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.988 -0.551 . . . . 71.230000000000004 110.937 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.56 HD13 ' HB2' ' A' ' 117' ' ' SER . 98.4 mt -65.29 -45.0 86.18 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.259 -0.428 . . . . 73.420000000000002 111.198 177.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -57.53 -43.57 84.46 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.534 0.207 . . . . 62.409999999999997 111.081 177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 62.5 m -54.65 -48.42 72.34 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.988 0.423 . . . . 73.239999999999995 111.505 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.8 pt -90.02 17.53 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 N-CA-C 112.159 0.429 . . . . 64.230000000000004 112.159 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 46.2 m-80 67.69 9.11 6.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 113.701 1.0 . . . . 72.239999999999995 113.701 174.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -87.52 43.56 1.12 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.83 -0.544 . . . . 61.299999999999997 111.76 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -62.15 -28.98 70.03 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 122.167 -0.333 . . . . 65.319999999999993 111.655 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.0 m -56.41 -27.76 57.41 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.764 0.316 . . . . 73.310000000000002 111.499 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.56 ' HB2' HD13 ' A' ' 109' ' ' LEU . 43.9 m -74.43 -26.78 60.28 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.107 0.41 . . . . 65.120000000000005 112.107 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.7 mt -55.93 -45.43 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 112.994 0.739 . . . . 62.340000000000003 112.994 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -68.84 -51.48 19.89 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 112.659 0.615 . . . . 73.409999999999997 112.659 -175.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -58.28 -28.69 85.38 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.638 1.559 . . . . 75.140000000000001 111.936 172.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.2 tt -66.04 -45.02 82.93 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 109.539 -0.541 . . . . 72.150000000000006 109.539 173.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.34 -38.18 82.99 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.057 0.456 . . . . 71.150000000000006 110.905 173.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.429 ' HG2' HD11 ' A' ' 10' ' ' LEU . 40.9 mt-10 -66.23 -32.56 74.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.365 -0.38 . . . . 64.510000000000005 111.013 174.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 70.1 m -65.01 -46.25 82.16 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 120.946 0.403 . . . . 64.450000000000003 110.863 175.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.419 HG23 ' HG ' ' A' ' 98' ' ' LEU . 45.1 mm -56.26 -50.76 69.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.427 0.632 . . . . 51.439999999999998 110.642 175.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.2 m -64.24 -41.2 97.1 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.399 -0.819 . . . . 55.219999999999999 111.748 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.1 t70 -60.65 -52.01 66.95 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.542 -0.299 . . . . 65.200000000000003 110.692 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' A' ' 81' ' ' MET . 93.2 t -58.04 -44.63 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-O 121.113 0.482 . . . . 73.25 111.252 177.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.576 ' HG ' HD11 ' A' ' 137' ' ' LEU . 14.0 tp -55.35 -51.98 65.01 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 121.4 0.619 . . . . 64.140000000000001 110.85 178.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 134' ' ' ARG . 90.3 t -75.5 -26.38 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 CA-C-N 115.728 -0.669 . . . . 54.049999999999997 112.032 -179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 22.3 tpp180 -61.46 -35.27 77.15 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 120.924 0.392 . . . . 73.010000000000005 111.969 -176.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.515 HG23 ' HG2' ' A' ' 133' ' ' LYS . 1.7 t -121.79 -33.19 3.62 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.801 0.667 . . . . 63.109999999999999 112.801 -176.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.515 ' HG2' HG23 ' A' ' 132' ' ' THR . 46.4 mmtm -114.72 20.53 15.17 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.262 0.838 . . . . 73.299999999999997 113.262 -172.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.418 ' HB2' HG13 ' A' ' 130' ' ' VAL . 44.1 ttp180 -56.41 -51.67 67.49 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.089 0.471 . . . . 71.430000000000007 111.637 177.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -58.66 -47.33 84.81 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 115.922 -0.581 . . . . 71.109999999999999 111.123 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -61.67 -37.15 83.02 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 111.611 0.226 . . . . 71.510000000000005 111.611 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.576 HD11 ' HG ' ' A' ' 129' ' ' LEU . 20.7 mt -58.29 -48.07 81.64 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.645 -0.252 . . . . 73.340000000000003 111.672 177.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.6 p -78.34 -39.66 24.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 112.161 0.43 . . . . 74.420000000000002 112.161 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -67.03 -49.7 64.4 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 112.413 0.523 . . . . 73.140000000000001 112.413 -177.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . 0.403 HE22 ' CE1' ' A' ' 164' ' ' HIS . 22.9 mm-40 -94.6 -1.35 53.43 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.698 0.285 . . . . 75.329999999999998 111.482 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.56 ' HD3' ' HB3' ' A' ' 161' ' ' HIS . 19.6 mtp180 55.63 79.02 0.17 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.406 0.622 . . . . 75.319999999999993 111.078 -177.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -54.47 -53.28 39.46 Favored Glycine 0 C--N 1.335 0.478 0 CA-C-N 115.244 -0.889 . . . . 64.310000000000002 114.28 -173.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -65.55 -40.03 92.38 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 117.132 0.466 . . . . 75.239999999999995 111.88 -175.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 6.4 m-20 -62.2 -58.55 7.34 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.829 0.347 . . . . 75.120000000000005 110.866 175.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -59.02 -31.19 68.04 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 121.329 -0.462 . . . . 45.219999999999999 112.831 178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -58.88 -55.73 31.34 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.167 0.508 . . . . 74.120000000000005 111.119 175.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.485 HG21 ' HG3' ' A' ' 39' ' ' LYS . 93.5 t -63.85 -36.83 77.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-N 116.147 -0.479 . . . . 64.510000000000005 111.568 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 55.1 mt-10 -66.82 -39.14 87.58 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.93 0.395 . . . . 73.340000000000003 111.236 176.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -61.32 -48.97 78.9 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 120.903 0.383 . . . . 73.319999999999993 111.788 -178.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -82.46 -22.53 35.16 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.011 0.374 . . . . 63.439999999999998 112.011 178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.1 t60 61.08 88.16 0.09 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.524 0.678 . . . . 60.299999999999997 111.044 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.476 HG21 HG23 ' A' ' 43' ' ' THR . 76.8 t -129.79 -74.93 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 CA-C-N 115.717 -0.674 . . . . 62.119999999999997 110.689 178.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.481 ' O ' ' HE3' ' A' ' 39' ' ' LYS . 62.7 mm-40 -116.41 79.82 1.37 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.387 0.613 . . . . 73.329999999999998 111.563 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -150.52 176.89 10.54 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.684 -0.689 . . . . 74.209999999999994 109.903 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.585 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -124.99 -17.25 5.84 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.869 0.692 . . . . 64.230000000000004 112.869 -176.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 62.18 -1.43 0.39 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.362 0.875 . . . . 73.450000000000003 113.362 179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -76.87 77.87 1.44 Allowed Glycine 0 CA--C 1.524 0.622 0 C-N-CA 121.077 -0.582 . . . . 72.239999999999995 112.206 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 107.65 -153.88 16.71 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 112.004 -0.438 . . . . 72.450000000000003 112.004 -175.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -167.1 125.66 1.34 Allowed 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.009 0.433 . . . . 65.010000000000005 111.565 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -78.05 29.18 0.17 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 120.874 0.368 . . . . 72.430000000000007 111.827 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . 0.56 ' HB3' ' HD3' ' A' ' 141' ' ' ARG . 3.3 p-80 -172.1 132.94 0.68 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.911 0.484 . . . . 62.409999999999997 110.96 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 1.4 p-80 -89.49 99.9 12.8 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-O 121.356 0.598 . . . . 61.420000000000002 110.804 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -66.91 148.08 52.41 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.454 -0.794 . . . . 74.540000000000006 112.273 -173.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.403 ' CE1' HE22 ' A' ' 140' ' ' GLN . 3.3 p-80 . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.807 -0.616 . . . . 74.310000000000002 111.172 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptm . . . . . 0 N--CA 1.492 1.654 0 N-CA-C 112.267 0.469 . . . . 72.439999999999998 112.267 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.435 ' HB2' ' NE ' ' A' ' 7' ' ' ARG . 2.9 mp0 -98.98 169.54 9.36 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.573 0.701 . . . . 63.409999999999997 112.518 -174.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -94.96 155.42 16.75 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 115.34 -0.846 . . . . 74.519999999999996 108.873 170.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 61.5 tt0 -61.28 -33.69 73.96 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 121.386 -0.821 . . . . 61.219999999999999 111.413 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -60.48 -35.39 75.78 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.088 0.47 . . . . 60.119999999999997 110.497 173.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -67.27 -36.15 81.0 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.046 -0.525 . . . . 74.230000000000004 110.24 176.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.488 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 4.4 mpt_? -61.98 -51.26 68.79 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.639 -0.255 . . . . 71.140000000000001 111.544 176.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.41 -48.01 83.6 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.018 0.437 . . . . 73.450000000000003 111.75 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 p -60.67 -52.81 63.57 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.389 -0.369 . . . . 51.240000000000002 111.344 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.9 tp -58.78 -35.96 73.65 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.008 0.433 . . . . 60.340000000000003 111.615 176.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 21.3 tt0 -59.27 -52.93 63.53 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.274 0.559 . . . . 75.310000000000002 110.619 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.1 mt -63.85 -53.96 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 CA-C-N 115.646 -0.707 . . . . 74.409999999999997 111.774 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.465 ' O ' HD13 ' A' ' 17' ' ' LEU . 82.8 mt -59.16 -49.85 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 N-CA-C 112.17 0.433 . . . . 74.150000000000006 112.17 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.7 t -55.16 -50.26 69.76 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 120.853 0.359 . . . . 71.230000000000004 111.524 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.686 ' HD3' ' SD ' ' A' ' 30' ' ' MET . 17.7 mtp180 -60.86 -42.78 98.54 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.636 -0.256 . . . . 72.099999999999994 111.593 178.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.416 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 85.1 t80 -58.48 -52.86 63.87 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.896 0.379 . . . . 75.420000000000002 111.765 178.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -54.47 -41.2 69.21 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.879 0.371 . . . . 60.350000000000001 111.581 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.434 ' NH2' ' HG3' ' A' ' 119' ' ' GLU . 19.4 mmt85 -65.2 -52.78 52.72 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.352 0.501 . . . . 65.230000000000004 112.352 178.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.634 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 11.2 pt-20 -62.39 -34.27 76.38 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.846 0.355 . . . . 75.129999999999995 111.955 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 33.3 mm-40 -69.64 -32.02 70.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.882 0.372 . . . . 73.109999999999999 111.208 176.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.52 -29.65 61.48 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.37 -0.377 . . . . 71.219999999999999 111.921 177.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.528 HG22 ' HE3' ' A' ' 110' ' ' LYS . 51.5 p -87.17 -30.43 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.826 0.346 . . . . 65.140000000000001 111.753 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.89 8.1 67.61 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 121.26 -0.495 . . . . 72.340000000000003 112.399 -176.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.97 124.42 8.3 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.797 0.332 . . . . 61.039999999999999 111.16 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 19' ' ' GLU . 0.0 OUTLIER -58.18 155.5 11.21 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 112.996 0.739 . . . . 74.450000000000003 112.996 -177.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -88.22 158.89 18.36 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.203 -0.453 . . . . 62.020000000000003 111.253 177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.9 t -116.64 -0.35 12.41 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.715 0.635 . . . . 70.549999999999997 112.715 -175.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -75.7 150.67 84.33 Favored Pre-proline 0 N--CA 1.473 0.708 0 O-C-N 122.172 -0.33 . . . . 73.120000000000005 111.784 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -53.59 140.79 64.91 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 122.478 2.119 . . . . 64.530000000000001 112.627 175.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.686 ' SD ' ' HD3' ' A' ' 15' ' ' ARG . 57.1 tpp -60.28 -71.08 0.14 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.119 0.414 . . . . 70.019999999999996 112.119 -176.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 157.37 -115.25 0.65 Allowed Glycine 0 CA--C 1.524 0.648 0 C-N-CA 121.122 -0.561 . . . . 72.0 112.614 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -80.87 -15.53 56.08 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 117.134 0.467 . . . . 72.329999999999998 111.88 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.514 ' OG ' ' HB3' ' A' ' 37' ' ' SER . 79.8 p -113.32 133.86 54.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 120.826 0.346 . . . . 71.120000000000005 111.13 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -107.37 -87.81 1.96 Allowed Glycine 0 CA--C 1.531 1.041 0 C-N-CA 121.024 -0.608 . . . . 74.230000000000004 113.93 -177.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.48 -50.83 69.85 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.917 0.71 . . . . 62.409999999999997 112.917 -175.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.8 m -57.77 -50.76 72.16 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 112.169 0.433 . . . . 72.019999999999996 112.169 -177.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.514 ' HB3' ' OG ' ' A' ' 33' ' ' SER . 79.8 p -57.78 -48.06 80.77 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.566 -0.288 . . . . 73.430000000000007 111.703 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.0 ttt-85 -52.97 -54.66 31.84 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.913 0.387 . . . . 71.439999999999998 111.288 176.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -55.86 -48.64 75.17 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.921 -0.582 . . . . 62.200000000000003 111.161 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.35 -41.34 98.84 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.273 -0.421 . . . . 71.219999999999999 111.829 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.24 -53.39 49.93 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 111.775 0.287 . . . . 71.510000000000005 111.775 -176.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -64.35 -31.34 72.51 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.771 0.32 . . . . 72.349999999999994 111.409 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.5 ' O ' HG22 ' A' ' 47' ' ' VAL . 86.2 m -67.17 -44.15 80.42 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.778 0.323 . . . . 62.039999999999999 110.57 174.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 39.2 mt -54.9 -44.19 73.93 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.495 0.554 . . . . 64.120000000000005 112.495 178.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -72.25 -37.54 69.09 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 112.538 0.57 . . . . 72.230000000000004 112.538 -177.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.411 ' NH1' HG13 ' A' ' 152' ' ' VAL . 16.1 ptm180 -73.77 -41.36 62.56 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.965 -0.46 . . . . 73.129999999999995 111.814 -179.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 43' ' ' THR . 17.2 m -79.11 -33.51 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 121.189 0.518 . . . . 64.549999999999997 110.734 176.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.42 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -59.68 -50.33 68.91 Favored Glycine 0 C--O 1.225 -0.451 0 CA-C-N 115.74 -0.664 . . . . 50.25 112.751 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -53.87 -46.59 71.37 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.898 0.349 . . . . 73.340000000000003 111.51 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -57.08 -48.41 79.87 Favored Glycine 0 CA--C 1.527 0.835 0 C-N-CA 121.14 -0.552 . . . . 73.219999999999999 112.9 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.443 ' HA ' HD21 ' A' ' 54' ' ' ASN . 70.9 t -63.52 -47.08 93.18 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 120.909 0.385 . . . . 73.0 111.378 176.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.5 mt-30 -55.18 -47.41 75.26 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 111.595 179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -57.81 -42.0 83.35 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.11 0.781 . . . . 73.239999999999995 113.11 -176.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.443 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.5 p30 -84.87 -27.58 26.59 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.821 -0.549 . . . . 70.319999999999993 111.906 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -90.72 -18.21 25.41 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 113.221 0.823 . . . . 74.409999999999997 113.221 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 31.7 tt0 -49.15 -51.12 34.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.862 0.689 . . . . 71.310000000000002 112.862 -170.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -57.71 -35.51 70.75 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.051 0.453 . . . . 44.399999999999999 111.655 178.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.05 -49.59 49.69 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.267 -0.424 . . . . 63.32 111.615 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -62.92 -40.8 98.71 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 111.697 0.258 . . . . 74.099999999999994 111.697 178.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.592 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 74.7 mm-40 -51.34 -44.7 62.09 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.597 0.237 . . . . 72.409999999999997 111.131 176.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.462 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -51.85 -38.72 46.32 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.229 -0.51 . . . . 61.240000000000002 112.826 176.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 84.9 mtp -73.3 -43.21 61.34 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.834 0.349 . . . . 54.520000000000003 111.121 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.402 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 8.7 mp -57.46 -29.36 64.14 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 112.15 0.426 . . . . 75.230000000000004 112.15 178.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.592 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 53.8 mtm180 -64.51 -10.99 29.43 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 112.621 0.6 . . . . 74.049999999999997 112.621 -178.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -122.3 -0.74 9.29 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.009 0.433 . . . . 73.400000000000006 111.424 173.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 62' ' ' MET . 96.1 mt -97.12 -78.99 0.46 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.385 -0.37 . . . . 75.150000000000006 110.889 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 68.11 -47.93 0.53 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.161 1.171 . . . . 72.310000000000002 114.161 179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.446 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.2 mp 65.58 114.82 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.7 0.8 . . . . 74.299999999999997 111.938 -177.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.48 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -114.54 -5.41 12.8 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 116.286 -0.416 . . . . 72.0 111.717 176.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.504 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -170.46 175.84 4.62 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.714 0.292 . . . . 65.530000000000001 111.341 172.615 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 37.8 tt0 -58.21 -24.04 57.82 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 111.995 0.369 . . . . 72.329999999999998 111.995 -178.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.428 ' HB3' HD21 ' A' ' 70' ' ' ASN . 36.9 t70 -56.01 -45.25 79.14 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.782 0.325 . . . . 71.329999999999998 111.016 176.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -63.6 -41.28 98.33 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.113 0.483 . . . . 65.340000000000003 110.412 175.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.0 t -56.74 -43.57 79.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-N 115.997 -0.547 . . . . 72.409999999999997 111.323 177.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 71' ' ' GLU . 65.3 mttm -60.15 -39.66 87.14 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 121.293 0.568 . . . . 74.099999999999994 110.564 175.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.1 t -66.79 -33.12 74.92 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.974 -0.557 . . . . 52.329999999999998 110.969 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 81' ' ' MET . 85.4 mt -61.01 -37.28 81.98 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.72 0.295 . . . . 54.119999999999997 110.798 174.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.4 t -52.75 -41.22 63.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.998 0.427 . . . . 72.310000000000002 111.098 177.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 79' ' ' ARG . 16.8 mmt85 -56.23 -44.58 79.7 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.164 0.507 . . . . 74.319999999999993 110.749 177.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.2 t -69.95 -41.08 79.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 115.782 -0.644 . . . . 70.140000000000001 111.392 178.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.463 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.5 mmt -55.54 -38.82 69.79 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.025 0.441 . . . . 71.140000000000001 111.605 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 70.9 mt -58.49 -40.72 79.62 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.248 0.547 . . . . 54.130000000000003 110.85 173.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.0 -25.8 60.09 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.912 -0.585 . . . . 64.450000000000003 112.47 -178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 94.9 t -54.0 -25.33 12.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-O 120.981 0.42 . . . . 75.310000000000002 111.709 175.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.614 ' HZ ' HD22 ' A' ' 98' ' ' LEU . 79.2 m-85 -94.87 10.61 34.69 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 112.474 0.546 . . . . 74.430000000000007 112.474 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.7 t -62.84 -10.55 13.6 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.629 0.603 . . . . 65.120000000000005 112.629 -176.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -64.67 -28.7 69.79 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.915 0.388 . . . . 63.420000000000002 111.675 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.82 -4.4 7.66 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 121.297 -0.478 . . . . 63.420000000000002 114.071 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.0 m -64.55 150.57 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 112.204 0.446 . . . . 72.349999999999994 112.204 -177.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 67.1 p -79.73 -34.37 40.04 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.832 0.349 . . . . 62.130000000000003 111.644 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 43.0 m-80 -50.68 151.75 2.27 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.011 -0.54 . . . . 73.420000000000002 112.416 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.566 ' HE3' HG13 ' A' ' 95' ' ' ILE . 90.9 m95 -81.35 3.15 25.31 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 112.756 0.65 . . . . 75.140000000000001 112.756 -175.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.24 -35.47 70.83 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 121.056 -0.592 . . . . 54.43 112.418 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HG2' ' O ' ' A' ' 91' ' ' ASN . 23.2 ptt180 -56.12 -40.49 73.83 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.865 0.466 . . . . 74.209999999999994 111.603 173.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.566 HG13 ' HE3' ' A' ' 92' ' ' TRP . 40.1 mm -67.79 -44.95 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-O 120.937 0.399 . . . . 73.329999999999998 110.563 178.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.6 t -55.06 -46.32 77.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 CA-C-N 116.099 -0.5 . . . . 74.530000000000001 111.118 176.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.7 m -58.78 -46.92 86.43 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.279 -0.419 . . . . 65.319999999999993 111.597 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.614 HD22 ' HZ ' ' A' ' 85' ' ' PHE . 26.2 tp -57.76 -55.02 40.23 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.213 0.53 . . . . 75.340000000000003 111.661 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.8 mt -69.19 -35.89 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.972 -0.558 . . . . 74.230000000000004 111.912 -174.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 93.8 p -68.19 -43.13 78.79 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.56 0.219 . . . . 54.43 111.172 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 20.9 t80 -63.18 -42.35 99.34 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.775 0.321 . . . . 73.049999999999997 111.101 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.91 -48.1 84.51 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.896 -0.668 . . . . 73.340000000000003 112.158 174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.427 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -64.41 -32.49 74.14 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.152 0.501 . . . . 51.140000000000001 111.353 176.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.466 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 39.3 t80 -63.81 -47.5 80.63 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.895 -0.593 . . . . 73.219999999999999 110.832 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.97 -36.39 77.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 116.286 -0.416 . . . . 54.299999999999997 110.515 175.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -54.14 -42.5 69.61 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 116.279 -0.418 . . . . 73.109999999999999 111.759 176.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -56.68 -49.11 76.06 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 121.438 0.637 . . . . 73.219999999999999 110.706 175.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -61.18 -33.47 73.49 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.492 -0.776 . . . . 71.319999999999993 111.07 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 91.6 mt -69.35 -49.57 54.36 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.429 -0.35 . . . . 63.109999999999999 111.869 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.528 ' HE3' HG22 ' A' ' 22' ' ' THR . 63.6 tttm -64.35 -33.55 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 120.723 0.297 . . . . 71.140000000000001 111.183 -179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 84.0 m -54.54 -44.02 72.46 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.167 0.508 . . . . 73.239999999999995 110.944 175.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.2 pt -95.43 31.78 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 CA-C-N 116.104 -0.498 . . . . 75.109999999999999 111.528 176.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 9.3 p30 48.71 22.18 0.5 Allowed 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.916 1.286 . . . . 64.310000000000002 114.224 177.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -93.61 35.98 1.1 Allowed 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.122 0.487 . . . . 73.150000000000006 110.81 173.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -54.9 -29.17 55.3 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 116.093 -0.503 . . . . 74.219999999999999 112.022 -178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.44 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 80.6 p -58.63 -41.57 86.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 120.789 0.328 . . . . 75.549999999999997 111.075 176.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.6 t -59.17 -26.37 64.72 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 112.268 0.47 . . . . 72.010000000000005 112.268 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.6 mt -54.3 -37.77 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.478 0.547 . . . . 74.349999999999994 112.478 -179.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.434 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 44.4 mt-10 -71.71 -52.88 7.75 Favored Pre-proline 0 CA--C 1.548 0.873 0 N-CA-C 112.418 0.525 . . . . 75.019999999999996 112.418 -176.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.44 ' HD2' ' O ' ' A' ' 116' ' ' SER . 12.0 Cg_endo -57.57 -30.01 87.04 Favored 'Trans proline' 0 C--N 1.359 1.127 0 C-N-CA 121.629 1.553 . . . . 65.329999999999998 111.961 172.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.45 -44.55 86.9 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.906 -0.405 . . . . 70.239999999999995 109.906 173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.7 -36.61 76.86 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.26 -0.427 . . . . 61.030000000000001 111.104 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -62.11 -43.7 98.27 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.574 -0.285 . . . . 54.149999999999999 110.655 174.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 73.6 m -60.86 -44.78 96.57 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 120.764 0.316 . . . . 43.310000000000002 111.415 175.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.9 mm -55.57 -52.43 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 CA-C-O 121.448 0.642 . . . . 72.409999999999997 111.094 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.1 m -67.78 -34.9 77.7 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.387 -0.824 . . . . 71.150000000000006 111.604 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.501 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 10.2 t70 -62.95 -52.45 62.98 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.471 -0.331 . . . . 73.209999999999994 110.709 -179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.463 HG21 ' HB2' ' A' ' 81' ' ' MET . 90.0 t -58.21 -35.03 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 121.43 0.633 . . . . 75.129999999999995 111.002 176.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 22.4 tp -65.24 -53.57 42.43 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.724 -0.671 . . . . 62.009999999999998 111.205 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -77.99 -29.01 15.51 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 N-CA-C 112.414 0.524 . . . . 64.430000000000007 112.414 -178.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 20.7 tpp180 -49.21 -40.3 33.04 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 112.564 0.579 . . . . 62.130000000000003 112.564 -174.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.669 HG23 ' HD3' ' A' ' 133' ' ' LYS . 1.3 t -130.64 -25.62 2.34 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 112.847 0.684 . . . . 64.430000000000007 112.847 -179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.669 ' HD3' HG23 ' A' ' 132' ' ' THR . 0.0 OUTLIER -95.6 17.55 14.62 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.65 -0.656 . . . . 73.409999999999997 111.968 177.211 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 6.7 tpt180 -45.41 -55.96 5.51 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.994 0.426 . . . . 75.140000000000001 111.894 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 5.3 m-20 -66.96 -50.62 61.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.223 -0.444 . . . . 63.520000000000003 111.163 -178.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 88.2 m95 -52.53 -36.74 56.11 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 111.967 0.358 . . . . 75.25 111.967 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 28.9 mt -57.58 -53.12 61.73 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 112.033 0.383 . . . . 72.099999999999994 112.033 177.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.5 p -77.16 -41.95 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 111.911 0.337 . . . . 71.450000000000003 111.911 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 75.4 mmtt -57.26 -49.88 74.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.995 0.426 . . . . 71.120000000000005 111.712 -179.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -95.17 2.42 55.02 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.016 0.376 . . . . 71.129999999999995 112.016 -177.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 57.7 mtt85 55.59 58.25 4.68 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.943 0.401 . . . . 74.530000000000001 111.382 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -43.3 -57.58 4.25 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 115.097 0.799 . . . . 62.329999999999998 115.097 -172.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -66.95 -26.26 66.74 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.402 0.519 . . . . 73.519999999999996 112.402 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -83.18 -51.22 7.68 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.871 0.367 . . . . 74.140000000000001 111.222 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -63.66 -33.94 88.6 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 116.359 -0.382 . . . . 72.510000000000005 113.196 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -53.59 -47.38 70.19 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.109 0.481 . . . . 73.030000000000001 111.887 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.29 -46.96 95.21 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 CA-C-N 116.08 -0.509 . . . . 51.130000000000003 112.007 -178.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.36 -27.15 61.33 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.08 0.4 . . . . 75.420000000000002 112.08 -179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -56.71 -48.99 76.48 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.909 0.385 . . . . 72.010000000000005 111.443 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.32 -14.83 52.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.012 0.434 . . . . 72.409999999999997 111.25 174.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.452 ' HE1' ' HA ' ' A' ' 155' ' ' LEU . 44.9 t60 68.19 85.25 0.14 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.685 0.794 . . . . 54.43 112.07 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.411 HG13 ' NH1' ' A' ' 46' ' ' ARG . 64.7 t -124.02 -71.41 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 CA-C-N 115.793 -0.639 . . . . 72.140000000000001 111.247 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -106.81 67.71 0.72 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.075 0.464 . . . . 72.420000000000002 110.355 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -169.72 -167.06 0.63 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.859 -0.609 . . . . 61.450000000000003 111.122 -176.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.56 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -147.93 11.56 0.95 Allowed 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.299 -0.41 . . . . 74.129999999999995 111.725 175.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.462 ' HG2' HD22 ' A' ' 155' ' ' LEU . 16.5 mm-40 -109.52 -11.92 14.75 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.341 0.497 . . . . 72.200000000000003 112.341 -175.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -62.31 99.58 0.25 Allowed Glycine 0 CA--C 1.527 0.843 0 C-N-CA 121.494 -0.384 . . . . 72.400000000000006 113.688 -178.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -76.12 62.59 2.94 Favored Glycine 0 CA--C 1.529 0.949 0 C-N-CA 121.434 -0.412 . . . . 32.039999999999999 113.255 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -68.06 116.15 8.36 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.216 0.45 . . . . 73.109999999999999 112.216 -178.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -112.28 -54.98 2.57 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.441 -0.345 . . . . 73.450000000000003 111.188 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -120.2 108.47 14.26 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.855 0.36 . . . . 74.310000000000002 111.253 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -87.63 130.01 34.92 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.929 0.395 . . . . 72.349999999999994 111.824 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -106.63 170.9 7.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 116.344 -0.389 . . . . 63.329999999999998 110.784 174.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 20.4 p80 . . . . . 0 C--O 1.258 1.519 0 N-CA-C 112.02 0.378 . . . . 74.219999999999999 112.02 178.667 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.4 ptm . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 121.26 0.553 . . . . 75.120000000000005 111.137 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -107.49 149.96 27.35 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 120.857 0.361 . . . . 71.540000000000006 111.943 -174.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -68.91 148.54 50.05 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.863 0.363 . . . . 63.229999999999997 111.045 172.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -59.09 -30.61 68.21 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 121.036 0.446 . . . . 74.140000000000001 110.535 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.427 HD22 ' HB ' ' A' ' 138' ' ' VAL . 58.5 tp -61.91 -43.52 98.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 116.105 -0.498 . . . . 72.540000000000006 110.859 173.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -63.19 -48.58 77.73 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.335 -0.393 . . . . 74.310000000000002 110.669 178.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -58.71 -39.35 80.54 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.943 0.349 . . . . 72.329999999999998 111.943 178.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.497 ' NE2' ' HB2' ' A' ' 33' ' ' SER . 7.9 tp60 -63.73 -52.39 60.69 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 120.969 0.414 . . . . 74.120000000000005 111.02 176.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.6 m -59.43 -46.09 89.71 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.024 -0.534 . . . . 72.109999999999999 111.197 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 60.0 tp -61.75 -38.98 89.99 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.949 -0.568 . . . . 73.439999999999998 111.476 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.44 -51.25 70.19 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.329 0.585 . . . . 65.239999999999995 110.892 177.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.5 mt -61.45 -54.32 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-N 115.542 -0.754 . . . . 72.219999999999999 111.597 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.409 HD13 HG22 ' A' ' 125' ' ' ILE . 75.1 mt -64.13 -46.28 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 116.031 -0.531 . . . . 71.129999999999995 112.097 -177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -56.99 -52.12 66.53 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.768 0.318 . . . . 74.430000000000007 111.727 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 15' ' ' ARG . 48.5 mtt180 -66.19 -32.61 74.14 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 111.727 0.269 . . . . 73.400000000000006 111.727 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -62.63 -54.66 36.24 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 122.101 -0.375 . . . . 75.540000000000006 110.849 176.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.7 mp -55.66 -45.01 77.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 120.699 0.285 . . . . 74.109999999999999 111.343 177.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -62.64 -63.35 1.25 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.478 0.547 . . . . 71.310000000000002 112.478 178.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 65.2 mm-40 -58.25 -34.86 70.93 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 112.649 0.611 . . . . 74.200000000000003 112.649 -174.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -80.33 -27.55 38.36 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 121.9 -0.5 . . . . 71.349999999999994 111.913 178.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.5 -33.75 69.52 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.151 0.501 . . . . 61.439999999999998 110.874 174.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 72.8 p -87.31 -30.31 20.94 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.021 -0.536 . . . . 61.240000000000002 111.418 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.98 19.59 46.44 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 121.302 -0.475 . . . . 61.140000000000001 112.644 -178.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -98.92 -167.14 1.44 Allowed 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.424 0.631 . . . . 74.329999999999998 112.337 -177.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -148.06 146.1 28.72 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 75.239999999999995 110.799 -178.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -105.58 159.87 15.62 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.313 0.578 . . . . 75.0 111.8 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.5 t -147.27 37.59 0.94 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 121.643 0.735 . . . . 53.43 110.577 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.439 ' HB3' ' HD2' ' A' ' 29' ' ' PRO . 64.0 mttm -128.23 165.02 33.68 Favored Pre-proline 0 N--CA 1.472 0.673 0 CA-C-N 115.849 -0.614 . . . . 55.240000000000002 111.701 -173.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.439 ' HD2' ' HB3' ' A' ' 28' ' ' LYS . 61.8 Cg_endo -75.16 148.46 34.69 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.324 2.016 . . . . 64.349999999999994 111.582 173.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.533 ' SD ' HD22 ' A' ' 41' ' ' LEU . 77.0 mtp -126.09 133.37 51.68 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.303 0.853 . . . . 74.310000000000002 113.303 -171.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 58.57 -150.69 34.15 Favored Glycine 0 CA--C 1.527 0.795 0 N-CA-C 114.941 0.736 . . . . 74.299999999999997 114.941 172.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 21.7 ttm180 -79.77 -53.39 6.84 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.913 0.387 . . . . 75.239999999999995 110.9 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.497 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 14.6 m -91.22 87.66 6.6 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 120.887 0.375 . . . . 70.299999999999997 110.238 175.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -53.91 -58.82 11.18 Favored Glycine 0 CA--C 1.525 0.688 0 CA-C-N 115.792 -0.64 . . . . 74.140000000000001 114.052 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.609 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -58.6 -51.4 70.05 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 111.879 0.325 . . . . 63.420000000000002 111.879 -177.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.9 m -57.86 -38.79 76.33 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.825 0.345 . . . . 62.409999999999997 111.604 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.407 ' HB3' ' HB2' ' A' ' 30' ' ' MET . 23.0 t -65.12 -51.33 61.93 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.448 -0.342 . . . . 52.109999999999999 111.319 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.6 tpt180 -58.67 -45.97 88.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.576 -0.284 . . . . 72.430000000000007 111.592 178.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.609 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 18.1 mtpp -56.08 -48.32 76.32 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 120.936 0.398 . . . . 74.120000000000005 110.969 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.94 -43.65 98.41 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.36 -0.382 . . . . 63.520000000000003 111.447 177.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.533 HD22 ' SD ' ' A' ' 30' ' ' MET . 55.9 tp -59.42 -53.32 59.57 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.158 0.429 . . . . 75.409999999999997 112.158 -179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.91 -31.47 71.27 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 122.234 -0.291 . . . . 33.030000000000001 111.655 -178.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.566 HG23 HG21 ' A' ' 152' ' ' VAL . 98.6 m -64.89 -43.01 94.3 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.814 0.34 . . . . 71.019999999999996 110.266 173.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.1 mt -54.12 -39.03 66.07 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.389 -0.369 . . . . 71.109999999999999 111.185 173.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 57.3 mtt180 -67.96 -45.8 73.2 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.765 0.317 . . . . 72.319999999999993 111.626 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 37.1 ttm-85 -61.0 -45.29 95.4 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 112.376 0.51 . . . . 71.109999999999999 112.376 -176.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.412 ' O ' HG23 ' A' ' 51' ' ' VAL . 31.3 m -87.52 -33.74 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 121.073 0.463 . . . . 72.329999999999998 111.321 178.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.407 ' HA2' ' HB ' ' A' ' 51' ' ' VAL . . . -69.44 -23.58 76.43 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 121.298 -0.477 . . . . 63.439999999999998 113.634 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.64 -53.78 34.99 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 117.183 0.492 . . . . 60.32 110.911 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.29 -44.38 28.51 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.061 -0.518 . . . . 62.039999999999999 113.017 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 47' ' ' VAL . 76.8 t -57.29 -46.06 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 112.527 0.565 . . . . 73.329999999999998 112.527 -176.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -57.31 -44.2 83.95 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 122.11 -0.369 . . . . 73.340000000000003 111.274 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 64.4 mtp180 -67.42 -54.11 23.21 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.47 0.545 . . . . 74.400000000000006 112.47 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -70.58 -20.06 62.81 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.208 0.447 . . . . 74.409999999999997 112.208 -176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 64.3 m-70 -90.3 -26.23 20.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 122.269 -0.269 . . . . 64.140000000000001 111.468 171.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.599 ' HG3' ' CE1' ' A' ' 104' ' ' PHE . 35.4 tt0 -53.08 -55.43 23.96 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 120.87 0.367 . . . . 70.239999999999995 111.518 179.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.1 t -56.4 -28.18 58.56 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.225 -0.443 . . . . 62.32 111.902 178.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.5 -44.63 20.86 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.904 0.383 . . . . 72.019999999999996 111.556 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.553 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.8 m-85 -70.8 -22.82 62.31 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.822 0.305 . . . . 65.349999999999994 111.822 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.448 ' NE2' ' HZ ' ' A' ' 104' ' ' PHE . 69.9 mm-40 -49.29 -35.88 19.28 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.966 0.412 . . . . 75.519999999999996 111.38 174.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -60.23 -30.43 70.83 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 121.267 -0.492 . . . . 60.420000000000002 112.988 177.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 72.8 mtm -89.11 -47.35 8.16 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.463 -0.433 . . . . 70.019999999999996 111.696 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.543 ' HA ' ' HB2' ' A' ' 66' ' ' LEU . 9.7 mp -56.85 -34.04 67.41 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 121.981 -0.449 . . . . 75.0 112.168 -179.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 33.0 ptt180 -63.3 -17.42 62.52 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-O 120.831 0.348 . . . . 73.140000000000001 111.808 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.1 pttt -113.92 1.67 14.8 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 120.718 0.294 . . . . 72.420000000000002 111.145 174.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.543 ' HB2' ' HA ' ' A' ' 63' ' ' LEU . 91.2 mt -102.94 -73.97 0.65 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.516 0.327 . . . . 64.040000000000006 111.286 178.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 40.95 84.65 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.79 -0.641 . . . . 72.530000000000001 112.065 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.504 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.7 mp -59.6 104.99 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-N 115.715 -0.675 . . . . 64.319999999999993 112.161 -173.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.54 -4.99 15.21 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.757 -0.656 . . . . 52.240000000000002 112.173 178.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.431 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -159.04 169.57 23.99 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 121.02 0.438 . . . . 43.030000000000001 111.798 173.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.67 -36.72 69.91 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.732 0.641 . . . . 73.409999999999997 112.732 -175.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -55.19 -35.05 64.41 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 111.689 0.255 . . . . 74.450000000000003 111.689 179.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.497 ' HB3' HG13 ' A' ' 68' ' ' ILE . 67.6 m-20 -62.56 -42.69 99.7 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.904 0.383 . . . . 71.230000000000004 110.81 176.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.9 t -60.81 -43.05 94.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.171 0.51 . . . . 74.230000000000004 110.637 176.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -65.78 -29.47 69.97 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.227 -0.442 . . . . 74.310000000000002 111.112 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.5 m -68.42 -37.71 80.56 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 120.83 0.348 . . . . 75.150000000000006 110.586 173.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.519 ' O ' ' HG2' ' A' ' 81' ' ' MET . 98.5 mt -58.45 -33.14 69.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.36 -0.382 . . . . 64.430000000000007 111.194 175.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.9 t -52.27 -41.4 62.82 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.857 0.36 . . . . 71.420000000000002 111.591 178.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -61.62 -37.47 84.08 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.396 -0.366 . . . . 72.150000000000006 111.614 178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.3 t -72.61 -41.65 63.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 120.976 0.417 . . . . 45.43 110.942 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 23.3 mmt -55.02 -42.75 72.99 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 116.016 -0.538 . . . . 54.43 111.487 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 82.0 mt -58.54 -40.96 80.58 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 116.201 -0.454 . . . . 72.510000000000005 111.237 175.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -67.98 -26.83 66.12 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 112.18 0.437 . . . . 74.409999999999997 112.18 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.526 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 62.1 t -56.7 -25.37 21.39 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 CA-C-O 121.149 0.499 . . . . 61.130000000000003 110.993 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.458 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.3 m-85 -92.56 5.0 52.48 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.808 0.67 . . . . 70.519999999999996 112.808 179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.3 m -54.55 -34.14 61.33 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 112.118 0.414 . . . . 62.219999999999999 112.118 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.497 ' HB2' ' HD2' ' A' ' 94' ' ' ARG . 3.7 m-20 -78.7 -53.63 6.94 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 120.75 0.31 . . . . 73.340000000000003 111.317 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 58.64 61.88 6.89 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-N 116.445 -0.343 . . . . 73.340000000000003 113.686 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 m -100.54 149.58 6.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 112.6 0.593 . . . . 71.430000000000007 112.6 -176.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 32.3 p -66.32 -7.03 16.25 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.901 0.704 . . . . 70.0 112.901 -178.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -73.29 -15.75 61.4 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.953 0.353 . . . . 70.040000000000006 111.953 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.539 ' HE3' HG13 ' A' ' 95' ' ' ILE . 93.4 m95 64.52 3.16 1.81 Allowed 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 122.823 0.449 . . . . 73.530000000000001 112.147 -176.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -58.42 -24.83 56.87 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 121.461 -0.4 . . . . 50.539999999999999 113.296 177.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.568 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 2.8 mmp_? -67.26 -33.04 74.47 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.462 -0.434 . . . . 75.540000000000006 111.255 176.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.539 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.1 mm -63.8 -46.11 95.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 121.303 0.573 . . . . 62.210000000000001 109.669 173.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.6 t -57.59 -44.43 85.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.704 -0.68 . . . . 64.439999999999998 110.904 175.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 31.0 m -61.57 -44.85 96.27 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.324 -0.398 . . . . 72.310000000000002 111.259 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.586 ' HG ' HG23 ' A' ' 125' ' ' ILE . 41.9 tp -58.49 -54.92 41.65 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.236 0.541 . . . . 71.109999999999999 111.209 178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.2 mt -65.65 -32.58 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 CA-C-N 115.98 -0.555 . . . . 74.219999999999999 111.221 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -64.36 -48.46 75.44 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 116.503 -0.317 . . . . 75.329999999999998 111.449 176.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.456 ' O ' HG23 ' A' ' 105' ' ' VAL . 14.3 t80 -61.39 -43.13 99.39 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 120.84 0.353 . . . . 74.329999999999998 110.582 177.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.73 -44.51 95.74 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 120.932 -0.652 . . . . 73.450000000000003 112.481 174.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.52 -39.36 94.22 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.689 0.28 . . . . 44.25 111.484 177.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.599 ' CE1' ' HG3' ' A' ' 56' ' ' GLU . 16.0 t80 -64.83 -45.53 85.76 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.805 0.336 . . . . 74.319999999999993 111.429 178.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.557 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 44.7 t -64.42 -37.94 81.3 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 121.973 -0.454 . . . . 74.140000000000001 110.023 175.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . 0.403 ' HA ' HD12 ' A' ' 109' ' ' LEU . . . -61.15 -50.69 72.16 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.338 0.496 . . . . 74.340000000000003 112.338 179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.69 -35.59 76.67 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 122.15 -0.344 . . . . 73.099999999999994 111.004 178.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.432 ' O ' HG12 ' A' ' 112' ' ' ILE . 86.6 t60 -68.05 -35.28 77.96 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.751 0.31 . . . . 70.519999999999996 110.627 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 85.7 mt -60.77 -49.47 77.37 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.654 -0.248 . . . . 73.120000000000005 111.057 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -62.79 -38.19 89.68 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.789 0.328 . . . . 71.430000000000007 110.93 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 99.6 m -53.6 -38.33 63.88 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.126 0.489 . . . . 73.019999999999996 111.084 175.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.432 HG12 ' O ' ' A' ' 108' ' ' HIS . 30.9 pt -103.59 19.5 3.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 CA-C-N 116.361 -0.382 . . . . 72.409999999999997 111.921 177.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 28.6 m-80 57.03 59.17 3.57 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.324 0.583 . . . . 70.239999999999995 112.396 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -131.17 33.89 4.08 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.915 -0.584 . . . . 74.209999999999994 110.984 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -56.77 -33.23 66.41 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.518 0.562 . . . . 74.310000000000002 112.518 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 52.0 m -54.98 -27.28 42.78 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 120.791 0.329 . . . . 74.510000000000005 111.606 176.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 36.0 t -79.18 -27.18 42.61 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.022 0.379 . . . . 42.399999999999999 112.022 178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.64 -45.14 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 N-CA-C 112.807 0.669 . . . . 65.030000000000001 112.807 -176.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -64.76 -53.32 44.44 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 112.712 0.634 . . . . 65.420000000000002 112.712 -176.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.34 -27.23 82.74 Favored 'Trans proline' 0 C--N 1.358 1.046 0 C-N-CA 121.598 1.532 . . . . 61.509999999999998 112.216 174.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -66.08 -44.43 84.5 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 109.362 -0.607 . . . . 74.430000000000007 109.362 173.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.11 -37.85 81.24 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.134 -0.485 . . . . 60.509999999999998 110.842 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -61.85 -40.03 93.91 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-N 116.221 -0.445 . . . . 64.450000000000003 110.79 173.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 61.6 m -62.96 -45.42 92.51 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.787 0.327 . . . . 73.200000000000003 111.246 177.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.586 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.7 -52.31 35.49 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 121.5 0.667 . . . . 74.349999999999994 110.669 174.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.404 ' OG1' HD12 ' A' ' 13' ' ' ILE . 25.4 m -68.24 -33.46 74.43 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 115.225 -0.898 . . . . 61.439999999999998 111.582 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.44 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 31.1 t70 -65.05 -51.97 58.47 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.744 -0.207 . . . . 75.420000000000002 111.282 -176.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 89.3 t -59.8 -41.92 87.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.275 0.56 . . . . 63.399999999999999 110.549 176.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' ' 137' ' ' LEU . 55.0 tp -55.97 -53.34 58.13 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.51 -0.768 . . . . 60.240000000000002 111.611 176.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 68.8 t -75.25 -26.52 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-N 115.902 -0.59 . . . . 73.530000000000001 111.843 -178.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 18.7 tpt180 -57.31 -37.32 72.31 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.005 0.372 . . . . 72.530000000000001 112.005 -176.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.595 HG23 ' HG2' ' A' ' 133' ' ' LYS . 2.7 t -125.07 -38.68 2.3 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 112.82 0.674 . . . . 63.130000000000003 112.82 -177.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.595 ' HG2' HG23 ' A' ' 132' ' ' THR . 33.0 mmtp -105.04 20.01 19.61 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 112.767 0.654 . . . . 53.340000000000003 112.767 -173.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 46.6 ttp180 -54.68 -54.27 43.96 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.232 0.539 . . . . 65.120000000000005 111.365 176.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -53.25 -44.81 68.43 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.533 -0.758 . . . . 72.409999999999997 111.659 179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -62.38 -38.22 88.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 111.776 0.287 . . . . 72.109999999999999 111.776 179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.559 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.9 mt -56.44 -50.07 72.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.614 0.245 . . . . 72.430000000000007 111.605 176.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.427 ' HB ' HD22 ' A' ' 5' ' ' LEU . 8.1 p -77.19 -43.46 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 N-CA-C 112.101 0.408 . . . . 62.409999999999997 112.101 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -62.36 -60.34 3.69 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 120.962 0.411 . . . . 71.120000000000005 111.808 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -81.97 -2.99 53.34 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.606 -0.27 . . . . 72.299999999999997 111.648 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 70.9 mtt180 57.14 61.76 2.45 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 110.836 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -51.21 -45.1 52.29 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.703 -0.68 . . . . 74.010000000000005 114.635 -173.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 55.4 m95 -72.85 -23.81 60.8 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 117.363 0.581 . . . . 74.120000000000005 111.786 -176.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -81.74 -47.37 13.0 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.301 0.572 . . . . 75.120000000000005 110.215 173.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.425 ' HA2' ' CG ' ' A' ' 148' ' ' GLU . . . -62.84 -30.71 77.99 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.778 -0.646 . . . . 15.31 113.369 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -58.76 -40.56 84.23 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 120.997 0.427 . . . . 64.140000000000001 111.58 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 48.6 t -73.57 -41.75 55.74 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 CA-C-N 116.307 -0.406 . . . . 74.109999999999999 112.056 -177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.446 ' HB2' ' HB2' ' A' ' 160' ' ' HIS . 0.0 OUTLIER -73.39 -31.63 64.0 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.714 0.635 . . . . 61.219999999999999 112.714 -178.162 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -59.04 -48.72 80.57 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.036 0.446 . . . . 70.540000000000006 111.487 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -83.8 -15.08 49.69 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.324 -0.398 . . . . 73.049999999999997 111.387 174.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 76.3 t60 55.77 68.24 0.89 Allowed 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.593 0.711 . . . . 64.450000000000003 111.114 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.566 HG21 HG23 ' A' ' 43' ' ' THR . 69.5 t -102.41 -60.21 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 115.632 -0.713 . . . . 71.319999999999993 112.631 -175.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -132.22 17.97 4.49 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.066 0.46 . . . . 73.5 111.12 -174.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -78.77 158.1 28.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.339 0.59 . . . . 74.200000000000003 111.939 -177.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.512 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -89.73 2.3 55.01 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 115.817 -0.629 . . . . 54.520000000000003 112.31 -177.439 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 63.07 84.31 0.15 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-O 121.076 0.465 . . . . 73.319999999999993 111.835 -177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -176.79 -151.9 9.36 Favored Glycine 0 CA--C 1.523 0.573 0 C-N-CA 120.586 -0.816 . . . . 74.239999999999995 113.52 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.7 -120.74 15.28 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 121.562 -0.351 . . . . 71.420000000000002 112.944 -176.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -141.49 55.02 1.52 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.28 0.562 . . . . 74.439999999999998 110.086 173.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 148' ' ' GLU . 5.1 p80 -54.98 124.55 17.12 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.416 -0.811 . . . . 64.230000000000004 111.984 -178.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -74.77 -54.42 7.37 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.717 -0.219 . . . . 62.119999999999997 111.432 -176.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 53.92 0.56 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.399 0 N-CA-C 113.684 0.994 . . . . 55.229999999999997 113.684 -179.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -84.49 159.69 20.69 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 121.665 -0.647 . . . . 73.219999999999999 111.261 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 17.9 m80 . . . . . 0 C--O 1.255 1.383 0 CA-C-O 119.177 -0.44 . . . . 64.319999999999993 111.46 -179.714 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.124 0.487 . . . . 64.439999999999998 110.931 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -141.67 123.85 15.56 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.912 -0.586 . . . . 72.329999999999998 111.031 -177.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -79.3 178.73 7.86 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.999 0.428 . . . . 62.439999999999998 111.959 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 62.4 tt0 -63.69 -45.55 89.55 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.492 -0.322 . . . . 70.540000000000006 111.839 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 137' ' ' LEU . 65.1 tp -61.02 -39.9 91.54 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.022 0.439 . . . . 75.409999999999997 111.146 -178.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.2 t80 -59.25 -47.91 83.58 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 116.202 -0.454 . . . . 75.230000000000004 110.951 174.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -44.36 94.53 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 111.939 0.348 . . . . 72.019999999999996 111.939 179.054 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -56.57 -52.44 64.8 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.256 0.551 . . . . 73.329999999999998 110.736 178.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.9 m -61.85 -43.78 98.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.775 -0.648 . . . . 75.129999999999995 111.261 178.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.8 tp -58.1 -46.71 85.07 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.284 -0.416 . . . . 75.349999999999994 111.544 178.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -58.07 -51.17 70.79 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.935 0.398 . . . . 73.420000000000002 111.151 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 70.5 mt -58.62 -50.67 78.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 121.004 0.43 . . . . 74.099999999999994 111.672 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.464 HD13 HG22 ' A' ' 125' ' ' ILE . 84.7 mt -65.94 -48.77 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 116.217 -0.447 . . . . 63.240000000000002 111.818 -178.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -55.34 -46.61 76.39 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.891 0.377 . . . . 71.349999999999994 110.845 179.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.611 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 3.3 mtt85 -53.86 -57.07 12.29 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.15 -0.477 . . . . 73.510000000000005 111.285 174.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 52.6 t80 -53.84 -45.33 70.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.394 0.516 . . . . 72.299999999999997 112.394 -175.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.23 -45.77 87.1 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.826 0.346 . . . . 75.409999999999997 111.292 177.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.7 mmm180 -61.49 -48.34 81.54 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.894 0.378 . . . . 74.329999999999998 111.296 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 18.6 mm-40 -56.15 -51.63 67.29 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.129 0.49 . . . . 74.5 111.803 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.509 HE21 ' HA ' ' A' ' 20' ' ' GLN . 0.1 OUTLIER -70.92 -36.25 72.59 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.161 -0.472 . . . . 73.219999999999999 112.094 -176.595 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.87 -36.5 72.83 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.043 0.386 . . . . 60.200000000000003 112.043 179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 46.5 p -95.2 -17.06 22.06 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 112.338 0.496 . . . . 74.329999999999998 112.338 -178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.95 48.12 12.27 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.228 -0.511 . . . . 60.299999999999997 113.236 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -129.88 174.23 9.93 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.345 0.498 . . . . 64.120000000000005 112.345 178.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.529 ' HA ' ' NH1' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -129.64 145.62 51.49 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 116.068 -0.515 . . . . 64.219999999999999 110.761 176.284 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -88.33 152.2 22.09 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 112.66 0.615 . . . . 74.340000000000003 112.66 -171.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.9 t -144.28 -5.8 0.75 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.53 -0.759 . . . . 74.230000000000004 112.007 178.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HE2' ' HB2' ' A' ' 28' ' ' LYS . 3.3 mppt? -81.14 153.02 71.8 Favored Pre-proline 0 N--CA 1.47 0.57 0 CA-C-O 120.699 0.285 . . . . 73.510000000000005 111.282 -177.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.25 131.53 23.69 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 122.347 2.032 . . . . 63.409999999999997 112.34 -179.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 55.5 tpp -60.41 149.23 34.64 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-O 121.163 0.506 . . . . 65.400000000000006 111.818 -176.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.63 4.7 67.73 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.279 0.871 . . . . 42.520000000000003 115.279 -173.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 25.6 tpt180 -155.64 -76.64 0.1 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.128 0.964 . . . . 71.209999999999994 112.003 178.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -95.01 136.54 35.2 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.453 -0.154 . . . . 72.209999999999994 110.864 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -81.36 -93.27 0.5 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 121.113 -0.565 . . . . 62.450000000000003 114.265 -177.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.9 -49.66 72.8 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.635 0.976 . . . . 63.310000000000002 113.635 -172.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 88.5 m -56.33 -46.23 80.02 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 111.949 0.351 . . . . 75.140000000000001 111.949 -175.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.2 p -63.67 -44.43 93.79 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.892 0.377 . . . . 73.239999999999995 111.302 179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 56.8 mtp180 -63.67 -54.04 41.9 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.1 0.408 . . . . 75.420000000000002 112.1 -179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HG3' HG21 ' A' ' 147' ' ' VAL . 0.2 OUTLIER -56.75 -37.93 71.72 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.814 0.34 . . . . 71.439999999999998 110.879 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.29 72.98 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.857 0.361 . . . . 73.129999999999995 111.445 176.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.414 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 44.2 tp -63.96 -44.93 91.28 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.423 -0.353 . . . . 65.420000000000002 111.828 -178.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -66.25 -34.49 78.12 Favored 'General case' 0 CA--C 1.537 0.461 0 O-C-N 122.181 -0.324 . . . . 74.299999999999997 110.677 178.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.575 ' O ' HG22 ' A' ' 47' ' ' VAL . 89.7 m -61.22 -46.58 89.85 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 120.738 0.304 . . . . 51.130000000000003 110.385 172.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -53.99 -31.64 51.52 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.441 -0.345 . . . . 72.430000000000007 111.673 175.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.529 ' NH1' ' HA ' ' A' ' 25' ' ' LYS . 65.3 mtt-85 -72.64 -54.88 7.84 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 122.031 -0.418 . . . . 74.109999999999999 111.272 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.434 ' NH1' HG13 ' A' ' 152' ' ' VAL . 15.8 ptm180 -63.69 -43.87 95.36 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.502 0.556 . . . . 75.409999999999997 112.502 -177.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.575 HG22 ' O ' ' A' ' 43' ' ' THR . 10.7 m -87.23 -33.63 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 O-C-N 122.119 -0.363 . . . . 72.530000000000001 111.824 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.42 -48.33 58.22 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 120.831 -0.7 . . . . 72.420000000000002 112.808 -176.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.593 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.0 t70 -57.27 -52.28 65.95 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.912 0.387 . . . . 71.310000000000002 110.719 176.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -54.21 -52.1 46.26 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 121.189 -0.529 . . . . 54.219999999999999 112.857 178.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.443 HG21 HG11 ' A' ' 96' ' ' VAL . 63.4 t -58.04 -43.43 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 111.726 0.269 . . . . 73.129999999999995 111.726 178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -55.73 -45.77 77.91 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.65 0.262 . . . . 60.539999999999999 111.52 177.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 53.2 mtp85 -66.81 -37.73 85.1 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.729 0.64 . . . . 74.019999999999996 112.729 -173.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.468 ' HB3' ' HD2' ' A' ' 163' ' ' HIS . 8.5 p30 -85.87 -22.15 27.67 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.592 -0.693 . . . . 73.25 112.142 177.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.447 ' HD2' ' OD1' ' A' ' 54' ' ' ASN . 12.9 m170 -86.43 -21.87 26.86 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 122.161 -0.337 . . . . 63.329999999999998 111.775 175.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -50.92 -48.46 60.69 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.414 0.524 . . . . 72.329999999999998 112.414 -176.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.7 t -56.3 -28.4 58.68 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.135 0.493 . . . . 75.409999999999997 112.079 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.57 -38.32 23.85 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 120.948 0.404 . . . . 61.310000000000002 111.718 176.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.412 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 18.3 m-85 -76.23 -33.16 59.21 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 112.624 0.601 . . . . 71.519999999999996 112.624 -176.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.418 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 63.5 mm-40 -46.29 -56.52 5.67 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.603 0.594 . . . . 72.219999999999999 112.603 -177.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -59.99 -22.65 58.12 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 121.367 -0.444 . . . . 44.420000000000002 114.139 -177.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.556 ' O ' ' HG3' ' A' ' 65' ' ' LYS . 26.4 mtm -87.4 -36.54 17.7 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 122.032 -0.687 . . . . 72.239999999999995 109.44 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.471 HD22 ' CE2' ' A' ' 104' ' ' PHE . 12.3 tp -60.1 -33.1 71.65 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.522 -0.763 . . . . 62.409999999999997 110.953 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 54.3 mtt85 -65.47 -42.78 91.89 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.741 -0.663 . . . . 74.420000000000002 112.056 179.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG3' ' O ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -77.1 -15.64 59.49 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.786 0.326 . . . . 75.099999999999994 110.781 177.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 62' ' ' MET . 95.8 mt -81.95 -80.82 0.15 Allowed 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 116.342 -0.39 . . . . 61.240000000000002 111.27 175.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.2 t70 45.24 90.44 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.34 0.656 . . . . 61.229999999999997 111.647 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.536 ' HB ' HD21 ' A' ' 109' ' ' LEU . 1.8 mp -68.55 102.96 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-O 121.244 0.545 . . . . 55.539999999999999 111.619 -175.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.8 -12.03 27.81 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.128 -0.487 . . . . 70.349999999999994 111.892 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.408 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -163.0 175.16 11.42 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.043 0.449 . . . . 63.340000000000003 112.02 174.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -50.83 -36.99 40.31 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 115.881 -0.6 . . . . 70.549999999999997 112.494 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.544 ' HA ' ' HE3' ' A' ' 75' ' ' LYS . 37.7 t70 -56.87 -39.71 74.85 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 111.879 0.325 . . . . 73.239999999999995 111.879 -177.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.529 ' HB2' HG23 ' A' ' 68' ' ' ILE . 30.0 m-20 -63.18 -36.07 82.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.883 0.373 . . . . 65.129999999999995 110.814 177.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.5 t -63.13 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.075 0.464 . . . . 65.299999999999997 110.511 175.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.544 ' HE3' ' HA ' ' A' ' 72' ' ' ASP . 9.6 mtmp? -63.96 -29.94 71.06 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 121.009 0.433 . . . . 75.310000000000002 110.821 175.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -67.57 -40.47 84.87 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 121.016 0.436 . . . . 64.319999999999993 110.618 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 81' ' ' MET . 86.1 mt -58.78 -34.73 71.77 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.402 -0.363 . . . . 71.239999999999995 111.211 176.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 47.0 m -52.16 -37.75 55.52 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.941 0.4 . . . . 65.219999999999999 110.945 176.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.499 ' HD3' HD12 ' A' ' 82' ' ' ILE . 31.0 mmt180 -64.07 -48.87 74.54 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.315 -0.402 . . . . 75.310000000000002 111.399 175.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 84' ' ' VAL . 86.8 t -55.29 -40.99 59.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.116 0.484 . . . . 61.140000000000001 110.489 175.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.522 ' HB2' HG21 ' A' ' 128' ' ' VAL . 22.2 mmt -60.79 -38.57 85.77 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.85 -0.614 . . . . 72.200000000000003 111.436 177.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.499 HD12 ' HD3' ' A' ' 79' ' ' ARG . 85.5 mt -61.32 -38.36 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-O 121.027 0.442 . . . . 72.549999999999997 110.623 173.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.413 ' HD2' ' O ' ' A' ' 79' ' ' ARG . 63.0 m-70 -68.8 -28.8 67.09 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.383 -0.371 . . . . 74.310000000000002 111.47 175.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 80' ' ' VAL . 95.1 t -61.37 -34.48 61.26 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.919 0.39 . . . . 75.329999999999998 111.183 174.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.517 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 22.8 m-85 -96.57 15.95 20.16 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.012 0.375 . . . . 75.319999999999993 112.012 176.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 40.4 t -69.44 -30.49 68.43 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.127 0.489 . . . . 51.310000000000002 110.511 175.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.68 104.83 2.09 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.871 -0.604 . . . . 71.230000000000004 111.012 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -74.74 67.33 1.99 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 121.331 -0.462 . . . . 74.239999999999995 112.896 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 18.8 t -132.28 141.4 45.41 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 CA-C-O 120.856 0.36 . . . . 72.549999999999997 111.103 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.8 t -77.5 4.95 9.89 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.937 0.717 . . . . 54.200000000000003 112.937 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -73.65 116.95 14.84 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.085 0.469 . . . . 75.140000000000001 111.689 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.535 ' HE3' HG13 ' A' ' 95' ' ' ILE . 95.9 m95 -60.15 -10.66 4.68 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 112.761 0.652 . . . . 74.140000000000001 112.761 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.05 -25.06 53.08 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 121.228 -0.51 . . . . 60.210000000000001 112.86 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -70.57 -35.58 73.14 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.519 -0.401 . . . . 71.510000000000005 111.046 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.535 HG13 ' HE3' ' A' ' 92' ' ' TRP . 45.3 mm -62.73 -45.31 99.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 CA-C-O 121.31 0.576 . . . . 72.409999999999997 110.037 173.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.443 HG11 HG21 ' A' ' 51' ' ' VAL . 43.5 t -56.02 -47.4 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-N 115.657 -0.702 . . . . 63.329999999999998 110.75 174.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 94.3 m -55.13 -44.14 74.79 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.537 -0.301 . . . . 54.210000000000001 111.517 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 125' ' ' ILE . 22.2 tp -58.46 -55.67 32.07 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.396 0.617 . . . . 65.310000000000002 111.648 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 55.8 mt -71.09 -32.56 48.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 115.784 -0.644 . . . . 64.530000000000001 111.317 -177.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.4 t -61.6 -52.05 66.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.892 -0.594 . . . . 74.430000000000007 111.244 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.497 ' O ' HG23 ' A' ' 105' ' ' VAL . 23.4 t80 -63.95 -35.99 82.48 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.692 0.282 . . . . 75.209999999999994 110.87 178.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.08 -48.67 84.95 Favored Glycine 0 CA--C 1.527 0.784 0 C-N-CA 120.985 -0.626 . . . . 72.010000000000005 112.574 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.92 -36.46 83.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 120.859 0.361 . . . . 74.510000000000005 111.348 177.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.471 ' CE2' HD22 ' A' ' 63' ' ' LEU . 78.3 t80 -60.72 -46.65 89.59 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.387 -0.369 . . . . 74.109999999999999 111.232 177.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 101' ' ' PHE . 58.0 t -64.88 -37.33 79.92 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 120.908 0.385 . . . . 74.120000000000005 110.512 175.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.73 -39.22 70.83 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.112 -0.495 . . . . 75.25 111.496 176.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -56.08 -49.27 74.26 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.359 0.6 . . . . 72.319999999999993 110.653 174.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.524 ' O ' HG12 ' A' ' 112' ' ' ILE . 58.3 t60 -63.35 -41.9 98.89 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.725 -0.671 . . . . 73.329999999999998 111.016 -179.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.536 HD21 ' HB ' ' A' ' 68' ' ' ILE . 88.5 mt -63.11 -49.96 72.4 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.062 0.458 . . . . 75.510000000000005 111.451 179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -59.67 -30.26 68.64 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.667 -0.697 . . . . 75.530000000000001 110.63 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.5 m -77.31 -48.75 16.58 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.008 -0.542 . . . . 70.530000000000001 112.246 177.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 108' ' ' HIS . 42.2 pt -83.79 24.32 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 N-CA-C 112.681 0.623 . . . . 73.329999999999998 112.681 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 62.4 18.09 10.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 112.549 0.574 . . . . 61.140000000000001 112.549 177.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -102.88 31.41 4.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.24 0.543 . . . . 62.509999999999998 110.406 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -57.26 -33.58 67.75 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.675 -0.693 . . . . 52.200000000000003 112.386 -173.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 62.3 m -56.34 -32.75 64.98 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 120.886 0.374 . . . . 61.399999999999999 111.772 178.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.461 ' HB2' HD13 ' A' ' 109' ' ' LEU . 48.2 m -62.29 -26.76 68.59 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.223 0.453 . . . . 65.420000000000002 112.223 -179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 69.3 mt -55.27 -44.22 74.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.849 0.685 . . . . 53.310000000000002 112.849 -178.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -64.04 -53.76 45.66 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 112.52 0.563 . . . . 63.5 112.52 -175.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.34 -28.05 71.77 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.833 1.689 . . . . 73.349999999999994 112.276 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 125' ' ' ILE . 7.2 tt -61.86 -40.68 96.22 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 120.99 0.424 . . . . 72.230000000000004 109.994 175.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.76 -33.83 73.53 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.239 -0.437 . . . . 75.129999999999995 111.233 175.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -65.43 -42.23 92.68 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 116.344 -0.389 . . . . 63.119999999999997 110.908 174.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 60.8 m -59.01 -45.33 90.96 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.956 0.408 . . . . 33.32 111.276 175.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.549 HG23 ' HG ' ' A' ' 98' ' ' LEU . 44.5 mm -57.27 -53.17 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 121.213 0.53 . . . . 65.209999999999994 111.09 177.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 36.7 m -65.55 -38.52 89.83 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.798 -0.637 . . . . 61.049999999999997 111.91 -178.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 29.5 t70 -59.39 -51.83 68.22 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.602 0.239 . . . . 62.119999999999997 111.226 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.522 HG21 ' HB2' ' A' ' 81' ' ' MET . 67.8 t -63.9 -39.62 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.928 0.394 . . . . 71.109999999999999 111.086 178.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.443 ' HG ' HD11 ' A' ' 137' ' ' LEU . 45.3 tp -55.63 -52.47 63.7 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.324 0.583 . . . . 73.0 110.902 176.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.474 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 95.0 t -72.76 -30.44 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 CA-C-N 115.806 -0.633 . . . . 71.310000000000002 111.633 178.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 2.0 tpt180 -57.36 -30.26 64.7 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 112.116 0.413 . . . . 74.109999999999999 112.116 -175.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.638 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.1 OUTLIER -130.18 -30.78 1.93 Allowed 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.451 0.908 . . . . 72.230000000000004 113.451 -176.887 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.638 ' HD2' HG23 ' A' ' 132' ' ' THR . 2.4 mptp? -112.36 23.83 13.2 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 121.425 -0.797 . . . . 73.329999999999998 113.007 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 16.2 ttp180 -53.85 -65.39 0.58 Allowed 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.666 0.746 . . . . 52.399999999999999 112.187 178.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -61.93 -31.6 71.94 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.154 -0.93 . . . . 61.420000000000002 111.097 -173.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -68.6 -35.82 77.87 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.404 -0.362 . . . . 62.549999999999997 111.621 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.56 ' HB2' HD21 ' A' ' 5' ' ' LEU . 52.6 mt -54.64 -45.6 73.82 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 120.555 0.217 . . . . 72.239999999999995 111.534 175.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.3 p -78.88 -43.78 24.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 N-CA-C 112.329 0.492 . . . . 51.119999999999997 112.329 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -60.87 -57.76 11.29 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-O 121.128 0.489 . . . . 73.239999999999995 112.167 -178.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -87.61 1.41 53.72 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.5 -0.318 . . . . 71.439999999999998 111.514 -177.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 62.4 mtp180 58.15 62.2 2.1 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.306 -0.406 . . . . 72.140000000000001 110.507 -178.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 146' ' ' PHE . . . -42.85 -52.56 5.58 Favored Glycine 0 C--O 1.223 -0.545 0 CA-C-N 115.689 -0.687 . . . . 74.150000000000006 114.319 -174.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 43.8 m95 -72.04 -21.06 61.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 112.439 0.533 . . . . 74.0 112.439 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -84.82 -58.22 2.8 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.1 0.476 . . . . 71.340000000000003 110.66 174.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.573 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -56.84 -32.04 61.65 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-N 115.978 -0.555 . . . . 61.299999999999997 113.112 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.432 ' HB2' ' O ' ' A' ' 142' ' ' GLY . 80.3 t80 -54.88 -39.26 68.51 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.317 0.58 . . . . 63.350000000000001 111.14 174.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.544 HG21 ' HG3' ' A' ' 39' ' ' LYS . 96.2 t -73.51 -43.2 55.72 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 CA-C-N 115.721 -0.672 . . . . 74.0 112.263 -178.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.573 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 10.0 pt-20 -73.31 -33.75 65.34 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 111.934 0.346 . . . . 53.119999999999997 111.934 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -56.66 -48.2 78.11 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.1 0.476 . . . . 73.129999999999995 111.232 -179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.49 -5.35 59.13 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.287 -0.415 . . . . 72.349999999999994 111.688 175.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 60.74 50.44 5.49 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.546 0.689 . . . . 74.439999999999998 111.917 175.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.465 HG21 ' OG1' ' A' ' 43' ' ' THR . 97.4 t -68.77 -29.13 42.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 CA-C-N 115.468 -0.787 . . . . 74.230000000000004 112.171 -178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.01 7.88 4.72 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.979 0.419 . . . . 73.120000000000005 111.186 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -103.0 120.66 41.04 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.154 -0.475 . . . . 72.329999999999998 112.183 -171.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.401 ' H ' ' CD1' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -67.91 -21.98 65.1 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.259 0.552 . . . . 42.049999999999997 110.665 172.129 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -81.39 57.34 3.22 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.939 -0.573 . . . . 71.519999999999996 111.115 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 149.26 136.26 2.61 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 121.028 -0.605 . . . . 75.519999999999996 113.505 176.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -97.06 -144.74 17.82 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 121.406 -0.426 . . . . 74.120000000000005 113.039 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -90.13 115.47 27.4 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.04 0.448 . . . . 72.239999999999995 111.718 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.25 -57.34 10.76 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.873 -0.603 . . . . 62.240000000000002 111.753 -178.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.11 145.18 17.92 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 116.484 -0.325 . . . . 72.329999999999998 110.593 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 14.6 p80 -149.51 -177.89 6.12 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.749 0.309 . . . . 73.310000000000002 111.074 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.468 ' HD2' ' HB3' ' A' ' 54' ' ' ASN . 33.3 t-80 -82.94 115.46 21.8 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.591 -0.277 . . . . 60.340000000000003 110.865 177.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.5 p80 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.862 -0.59 . . . . 74.439999999999998 111.341 177.836 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ptt? . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 111.961 0.356 . . . . 75.25 111.961 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -85.97 156.58 20.41 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.161 0.505 . . . . 62.5 112.236 -175.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' A' ' 6' ' ' TYR . 19.4 t70 -54.98 149.78 11.26 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.951 -0.568 . . . . 70.349999999999994 111.287 174.007 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.455 ' HG2' ' NH1' ' A' ' 32' ' ' ARG . 30.1 tt0 -56.71 -46.03 81.49 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.242 0.544 . . . . 74.409999999999997 111.496 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.548 HD21 ' HB2' ' A' ' 137' ' ' LEU . 59.8 tp -68.96 -33.5 73.8 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.218 -0.447 . . . . 62.450000000000003 110.69 177.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.411 ' HB2' ' HB3' ' A' ' 3' ' ' ASP . 6.6 t80 -59.88 -47.19 86.78 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.246 -0.434 . . . . 64.409999999999997 109.954 174.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -57.04 -49.64 75.21 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.965 0.358 . . . . 73.030000000000001 111.965 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 11' ' ' GLU . 60.6 tt0 -62.53 -48.17 80.72 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.426 0.631 . . . . 63.100000000000001 111.475 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.3 m -59.86 -32.09 70.37 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.117 0.484 . . . . 54.200000000000003 110.751 176.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 tp -72.75 -46.22 54.55 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.131 -0.486 . . . . 73.340000000000003 111.865 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 8' ' ' GLN . 14.1 pt-20 -57.59 -43.07 84.33 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 120.965 0.412 . . . . 63.240000000000002 110.765 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 67.1 mt -65.15 -54.7 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 116.053 -0.521 . . . . 61.219999999999999 111.895 179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 125' ' ' ILE . 76.5 mt -66.4 -51.16 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.836 0.35 . . . . 72.129999999999995 111.857 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.511 ' HA ' ' HB1' ' A' ' 122' ' ' ALA . 47.7 t -50.04 -51.27 43.55 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 116.229 -0.441 . . . . 72.420000000000002 111.559 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.535 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 28.0 mtp180 -58.75 -45.99 88.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 120.853 -0.339 . . . . 74.099999999999994 111.517 176.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -53.43 -44.18 68.61 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.882 0.327 . . . . 64.349999999999994 111.882 -176.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.3 mp -62.22 -42.65 99.5 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.815 -0.175 . . . . 63.420000000000002 111.348 177.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.554 ' NH2' ' HG2' ' A' ' 119' ' ' GLU . 8.4 mpt_? -61.55 -48.26 81.79 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.689 0.28 . . . . 63.109999999999999 111.34 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 16.1 mm-40 -54.45 -46.81 73.36 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.415 0.626 . . . . 65.319999999999993 111.062 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.688 ' HG3' ' HE2' ' A' ' 107' ' ' LYS . 8.6 tp-100 -75.64 -43.05 49.75 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.761 -0.654 . . . . 73.329999999999998 112.369 -175.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.63 -40.27 80.38 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.251 0.463 . . . . 61.43 112.251 -177.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.8 p -87.02 -28.62 22.51 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 120.799 0.333 . . . . 55.399999999999999 111.644 -177.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.88 6.27 88.56 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.213 -0.517 . . . . 72.109999999999999 112.875 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.79 115.19 23.37 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 120.9 0.381 . . . . 72.510000000000005 111.443 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -74.83 128.76 36.35 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.296 -0.411 . . . . 73.310000000000002 111.025 177.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -103.94 153.34 20.92 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.383 0.611 . . . . 72.430000000000007 111.898 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.0 t -94.32 1.48 55.9 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.005 -0.543 . . . . 73.510000000000005 112.253 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 96.8 mttt -51.16 137.99 27.21 Favored Pre-proline 0 N--CA 1.477 0.875 0 N-CA-C 112.213 0.449 . . . . 74.010000000000005 112.213 177.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 28' ' ' LYS . 17.5 Cg_exo -66.33 72.76 0.39 Allowed 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.27 2.647 . . . . 62.509999999999998 113.709 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.6 mmm 37.44 -89.46 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.89 1.07 . . . . 75.0 113.89 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -173.0 -50.12 0.05 OUTLIER Glycine 0 CA--C 1.528 0.851 0 CA-C-N 116.488 -0.324 . . . . 75.329999999999998 112.575 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.455 ' NH1' ' HG2' ' A' ' 4' ' ' GLU . 27.9 ttt180 -137.66 -64.42 0.55 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.092 0.472 . . . . 74.319999999999993 111.203 178.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.568 ' HB2' ' OG ' ' A' ' 37' ' ' SER . 42.6 m -83.05 170.96 14.28 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 121.219 0.533 . . . . 75.109999999999999 112.433 -172.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -110.88 -93.21 2.18 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 116.033 -0.531 . . . . 75.109999999999999 113.783 -176.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -51.88 -50.13 61.6 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.862 0.69 . . . . 72.010000000000005 112.862 -174.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.531 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 90.5 m -64.3 -40.48 96.02 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 120.866 0.365 . . . . 75.129999999999995 111.635 -177.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.568 ' OG ' ' HB2' ' A' ' 33' ' ' SER . 62.2 m -66.06 -42.19 89.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.712 0.291 . . . . 43.530000000000001 111.453 178.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -68.87 -52.77 26.14 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.627 0.251 . . . . 74.409999999999997 111.335 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HB2' HG11 ' A' ' 147' ' ' VAL . 20.6 ptmt -54.97 -39.49 69.03 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.958 0.409 . . . . 62.549999999999997 110.556 -177.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.1 -53.2 33.05 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 116.261 -0.427 . . . . 74.329999999999998 111.706 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.559 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.0 tp -59.55 -40.51 87.49 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.521 0.563 . . . . 75.299999999999997 112.521 -176.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 12.3 pt-20 -73.4 -41.39 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 122.273 -0.267 . . . . 75.239999999999995 111.442 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.453 ' O ' HG22 ' A' ' 47' ' ' VAL . 82.7 m -69.26 -34.34 74.63 Favored 'General case' 0 N--CA 1.47 0.565 0 O-C-N 122.097 -0.377 . . . . 65.010000000000005 111.275 178.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 32.9 mt -56.51 -44.05 80.37 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 111.883 0.327 . . . . 60.399999999999999 111.883 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.559 HH21 ' HG ' ' A' ' 41' ' ' LEU . 19.2 ptp180 -78.61 -32.38 47.47 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.996 0.427 . . . . 65.319999999999993 110.962 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.446 HH11 ' HD2' ' A' ' 46' ' ' ARG . 20.8 ttt180 -58.62 -44.88 90.11 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 116.061 -0.518 . . . . 75.219999999999999 111.759 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 43' ' ' THR . 32.8 m -91.66 -33.11 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 CA-C-O 121.014 0.435 . . . . 74.25 111.223 175.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.46 -32.55 73.25 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 116.167 -0.47 . . . . 61.210000000000001 113.759 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 14.6 t70 -53.44 -56.65 15.08 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 117.088 0.444 . . . . 74.530000000000001 110.875 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -67.9 -43.79 81.63 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 121.018 -0.61 . . . . 32.310000000000002 113.066 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.433 ' HA ' HD21 ' A' ' 54' ' ' ASN . 69.7 t -57.34 -46.06 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 112.039 0.385 . . . . 74.430000000000007 112.039 -178.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -63.12 -28.07 69.82 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.878 0.325 . . . . 75.129999999999995 111.878 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 46.9 mtt180 -69.29 -52.67 25.17 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 122.329 -0.232 . . . . 74.409999999999997 111.422 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.433 HD21 ' HA ' ' A' ' 51' ' ' VAL . 7.7 p30 -74.47 -23.06 58.82 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.824 0.345 . . . . 73.299999999999997 111.791 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.422 ' HB3' ' CE2' ' A' ' 59' ' ' PHE . 17.1 m170 -82.66 -22.63 34.55 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 111.593 0.22 . . . . 72.340000000000003 111.593 173.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 43.1 tt0 -50.71 -56.6 11.21 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.102 0.408 . . . . 74.030000000000001 112.102 -176.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.4 t -54.89 -37.9 66.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.208 0.447 . . . . 72.200000000000003 112.208 -178.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -73.51 -46.04 50.28 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.893 0.378 . . . . 70.239999999999995 111.61 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.422 ' CE2' ' HB3' ' A' ' 55' ' ' HIS . 21.1 m-30 -64.63 -40.22 95.07 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.307 -0.406 . . . . 72.430000000000007 111.776 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.607 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 76.4 mm-40 -44.97 -55.07 5.84 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 120.779 0.323 . . . . 74.150000000000006 111.446 177.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.53 -34.76 49.99 Favored Glycine 0 CA--C 1.528 0.846 0 CA-C-N 116.154 -0.476 . . . . 64.329999999999998 113.961 -179.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 50.8 mtm -79.46 -44.18 21.83 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 122.15 -0.618 . . . . 63.340000000000003 111.256 179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.84 -32.81 69.75 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 111.665 0.246 . . . . 71.439999999999998 111.665 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 79.5 mtp180 -59.99 -34.87 73.91 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.364 0.602 . . . . 70.439999999999998 111.34 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -84.01 -38.88 20.36 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.95 -0.568 . . . . 62.210000000000001 111.153 177.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 77' ' ' LEU . 83.9 mt -69.56 -76.72 0.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.971 -0.559 . . . . 75.010000000000005 111.823 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.3 t70 43.67 85.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.714 0 CA-C-O 121.312 0.577 . . . . 74.319999999999993 111.281 -172.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.52 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.7 mp -60.23 106.66 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 115.834 -0.621 . . . . 35.240000000000002 111.852 -174.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.41 ' HE2' ' HB2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -104.77 -5.88 20.83 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.183 0.438 . . . . 71.420000000000002 112.183 -179.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.524 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -162.92 173.71 13.32 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.808 0.337 . . . . 64.420000000000002 111.865 174.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.28 -35.99 65.64 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.012 0.434 . . . . 53.399999999999999 111.907 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -51.55 -41.7 61.28 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.186 -0.461 . . . . 65.329999999999998 112.004 179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.52 ' HB2' HG23 ' A' ' 68' ' ' ILE . 42.6 m-20 -60.47 -41.19 93.67 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 120.686 0.279 . . . . 73.540000000000006 111.285 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.24 -42.75 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.276 0.56 . . . . 70.209999999999994 110.936 178.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -70.02 -28.58 65.6 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.132 -0.485 . . . . 75.340000000000003 111.195 176.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -68.45 -37.31 80.08 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.168 0.508 . . . . 73.120000000000005 110.252 171.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 81' ' ' MET . 95.5 mt -60.43 -38.89 85.52 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.172 -0.467 . . . . 53.329999999999998 110.771 174.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.433 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.8 t -52.68 -37.92 59.67 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.121 0.486 . . . . 75.230000000000004 111.137 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -65.58 -40.33 92.6 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.141 -0.481 . . . . 75.099999999999994 110.514 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 76.2 t -64.93 -40.41 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-O 120.946 0.403 . . . . 72.030000000000001 110.896 174.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.476 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.5 mmt -57.17 -36.59 70.96 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.213 0.53 . . . . 72.420000000000002 110.759 177.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -62.08 -40.69 88.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 115.988 -0.551 . . . . 65.209999999999994 110.931 172.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -65.0 -32.6 74.41 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.007 0.373 . . . . 64.430000000000007 112.007 178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 93.6 t -54.62 -41.21 54.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.027 0.441 . . . . 61.229999999999997 111.609 178.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.484 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 50.8 m-85 -85.37 -5.38 59.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.016 0.376 . . . . 75.150000000000006 112.016 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.6 t -83.59 -8.36 59.33 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 120.887 0.375 . . . . 73.239999999999995 111.292 178.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -50.85 -31.86 18.52 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.159 0.584 . . . . 73.209999999999994 112.181 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 118.07 -74.0 0.29 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 121.181 -0.533 . . . . 72.409999999999997 112.797 178.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 18.1 m -74.54 68.85 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.721 0 CA-C-O 121.592 0.711 . . . . 74.230000000000004 111.497 177.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.62 ' HA ' ' HG3' ' A' ' 94' ' ' ARG . 57.2 m -68.61 84.15 0.28 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.313 0.578 . . . . 73.030000000000001 111.729 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -109.3 -177.02 3.18 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.853 -0.612 . . . . 55.549999999999997 110.907 176.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -63.24 -25.58 68.39 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 120.993 0.425 . . . . 73.420000000000002 111.166 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -61.75 -29.07 71.15 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 121.04 -0.6 . . . . 33.409999999999997 112.832 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.769 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 1.3 mmp_? -73.07 -32.38 64.98 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.495 -0.414 . . . . 71.230000000000004 111.001 176.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 46.7 mm -58.82 -44.73 91.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 121.239 0.543 . . . . 71.140000000000001 109.933 173.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 31.3 t -58.65 -43.83 88.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.814 -0.63 . . . . 70.150000000000006 110.762 174.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.4 m -54.79 -50.43 68.54 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.034 0.445 . . . . 72.299999999999997 111.218 177.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.508 ' HG ' HG23 ' A' ' 125' ' ' ILE . 34.9 tp -60.38 -54.83 40.89 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.833 -0.622 . . . . 72.409999999999997 112.111 -179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 58.3 mt -65.83 -41.03 89.28 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 112.011 0.374 . . . . 71.409999999999997 112.011 -176.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.1 p -59.75 -42.42 93.18 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 120.627 0.251 . . . . 75.340000000000003 111.336 178.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.48 ' O ' HG23 ' A' ' 105' ' ' VAL . 21.7 t80 -63.05 -44.01 97.07 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.613 0.244 . . . . 53.350000000000001 110.932 177.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.17 -45.93 93.4 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.051 -0.595 . . . . 70.25 112.917 177.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.24 -38.91 78.71 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.035 0.445 . . . . 61.25 111.689 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -62.02 -43.43 98.86 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.024 0.44 . . . . 71.420000000000002 110.894 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.484 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 91.2 t -65.11 -38.33 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.405 -0.361 . . . . 62.509999999999998 110.678 176.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -52.99 -43.12 66.21 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.794 0.33 . . . . 64.209999999999994 111.609 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.688 ' HE2' ' HG3' ' A' ' 20' ' ' GLN . 61.9 mttm -56.61 -49.22 75.57 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.209 0.528 . . . . 71.140000000000001 111.295 174.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.507 ' O ' HG12 ' A' ' 112' ' ' ILE . 77.1 t60 -62.66 -35.38 79.46 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.145 -0.48 . . . . 73.140000000000001 110.938 179.297 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' ' 117' ' ' SER . 96.1 mt -62.73 -49.52 74.74 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.34 -0.391 . . . . 74.230000000000004 110.977 177.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.482 ' HA ' ' HG3' ' A' ' 115' ' ' GLU . 85.8 tttt -57.99 -41.53 83.2 Favored 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 116.312 -0.403 . . . . 72.010000000000005 111.569 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 96.4 m -59.86 -41.58 91.8 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 116.13 -0.486 . . . . 63.299999999999997 111.849 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.507 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.5 pt -94.53 23.86 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.099 0.407 . . . . 74.439999999999998 112.099 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 70.37 1.36 3.57 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 113.096 0.776 . . . . 71.200000000000003 113.096 174.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 68' ' ' ILE . 15.1 mm100 -86.22 35.62 0.65 Allowed 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 112.549 0.574 . . . . 71.349999999999994 112.549 -175.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.482 ' HG3' ' HA ' ' A' ' 110' ' ' LYS . 37.6 mt-10 -56.65 -31.76 64.7 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.671 0.272 . . . . 62.0 111.71 177.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 m -55.06 -32.35 61.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.002 0.43 . . . . 73.439999999999998 111.319 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . 0.499 ' HB2' HD13 ' A' ' 109' ' ' LEU . 50.1 m -70.17 -27.72 64.75 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.138 -0.483 . . . . 70.510000000000005 112.157 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 74.4 mt -54.51 -41.11 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.254 0.465 . . . . 64.540000000000006 112.254 -178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.554 ' HG2' ' NH2' ' A' ' 18' ' ' ARG . 30.8 mt-10 -65.57 -55.91 21.56 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 112.724 0.639 . . . . 73.319999999999993 112.724 -174.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.84 -28.15 51.1 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 121.78 1.653 . . . . 63.409999999999997 112.355 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.443 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.2 tt -64.29 -45.26 88.75 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 109.87 -0.419 . . . . 71.450000000000003 109.87 175.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.511 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -57.06 -37.61 72.06 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 120.969 0.414 . . . . 71.049999999999997 111.196 175.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.51 -36.52 73.81 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.179 -0.464 . . . . 73.219999999999999 111.718 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 80.0 p -62.58 -41.2 98.8 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-O 120.797 0.332 . . . . 75.230000000000004 111.318 178.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.508 HG23 ' HG ' ' A' ' 98' ' ' LEU . 42.7 mm -53.02 -52.91 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 121.396 0.617 . . . . 63.399999999999999 110.975 177.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 22.9 m -69.55 -33.61 73.01 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.843 -0.617 . . . . 52.340000000000003 111.523 178.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -59.57 -52.91 63.53 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.684 0.278 . . . . 75.140000000000001 111.371 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' A' ' 81' ' ' MET . 59.6 t -65.43 -41.16 90.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 121.11 0.481 . . . . 61.310000000000002 110.818 178.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.566 ' HG ' HD11 ' A' ' 137' ' ' LEU . 51.9 tp -54.81 -52.39 62.84 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.847 -0.615 . . . . 74.129999999999995 111.427 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.415 HG13 ' HD3' ' A' ' 134' ' ' ARG . 92.7 t -75.57 -26.94 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.142 -0.481 . . . . 75.209999999999994 111.708 -179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -60.53 -26.51 66.93 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.021 0.378 . . . . 73.129999999999995 112.021 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.598 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -131.44 -40.82 1.1 Allowed 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 114.051 1.13 . . . . 71.409999999999997 114.051 -179.316 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.598 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.3 mptp? -103.25 20.64 17.34 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 113.692 0.997 . . . . 74.540000000000006 113.692 -174.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.541 ' HG3' HD23 ' A' ' 5' ' ' LEU . 53.9 ttp180 -56.05 -51.27 68.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.293 0.497 . . . . 74.310000000000002 111.607 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -57.39 -45.78 84.14 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.298 -0.41 . . . . 73.439999999999998 111.31 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -62.99 -38.33 90.74 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.411 -0.359 . . . . 64.329999999999998 111.586 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.566 HD11 ' HG ' ' A' ' 129' ' ' LEU . 65.1 mt -56.15 -49.74 73.09 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.916 0.339 . . . . 70.010000000000005 111.916 178.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.2 p -78.09 -42.25 27.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 112.166 0.432 . . . . 74.439999999999998 112.166 -179.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -67.59 -62.47 1.4 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.169 0.433 . . . . 74.420000000000002 112.169 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -79.5 -8.69 59.31 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.809 0.338 . . . . 70.420000000000002 111.441 -178.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 137' ' ' LEU . 46.2 mtt-85 60.62 83.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.551 0.691 . . . . 75.030000000000001 111.245 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -66.61 -52.92 31.03 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 115.291 -0.868 . . . . 64.219999999999999 114.125 -174.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.416 ' O ' HG23 ' A' ' 147' ' ' VAL . 50.2 m95 -68.0 -39.73 83.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.007 0.432 . . . . 73.140000000000001 111.437 -175.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -70.6 -52.8 19.03 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.788 0.327 . . . . 70.099999999999994 110.901 175.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -57.3 -38.87 88.88 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 116.182 -0.463 . . . . 63.340000000000003 113.446 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.57 -56.32 23.72 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.254 0.55 . . . . 73.0 111.59 176.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.557 HG11 ' HB2' ' A' ' 39' ' ' LYS . 90.1 t -59.93 -45.21 95.44 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.285 0.564 . . . . 72.340000000000003 112.053 -178.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.613 ' HG2' ' HA ' ' A' ' 154' ' ' ASP . 40.1 mt-10 -73.68 -24.88 60.02 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.958 -0.565 . . . . 71.239999999999995 111.883 -178.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . 0.561 ' HA ' ' O ' ' A' ' 161' ' ' HIS . 78.3 t80 -58.05 -49.1 78.04 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.051 0.453 . . . . 71.109999999999999 110.835 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -82.52 -3.79 56.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 111.995 0.368 . . . . 75.439999999999998 111.995 178.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 24.1 t60 60.41 81.47 0.18 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.16 0.505 . . . . 72.409999999999997 111.702 179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 61.7 t -129.59 -67.39 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 121.21 0.528 . . . . 71.430000000000007 110.545 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -119.75 69.42 0.84 Allowed 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.699 -0.682 . . . . 64.109999999999999 110.245 174.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.613 ' HA ' ' HG2' ' A' ' 148' ' ' GLU . 3.1 p30 -99.13 140.67 32.94 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.753 -0.658 . . . . 64.239999999999995 112.574 -175.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.49 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -109.93 -2.1 17.35 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.443 0.64 . . . . 72.430000000000007 109.719 172.041 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.472 ' HA ' ' HB3' ' A' ' 160' ' ' HIS . 43.3 mt-10 80.2 -60.85 0.29 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 114.559 -1.2 . . . . 72.310000000000002 111.968 174.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . 39.0 29.56 0.09 OUTLIER Glycine 0 CA--C 1.533 1.163 0 O-C-N 123.648 0.592 . . . . 53.200000000000003 114.308 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 71.73 -41.78 0.7 Allowed Glycine 0 CA--C 1.535 1.338 0 O-C-N 122.479 -0.424 . . . . 62.25 114.017 -174.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -92.38 4.29 53.7 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 113.737 1.014 . . . . 74.310000000000002 113.737 -169.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 156' ' ' GLU . 28.7 p-80 -55.46 106.5 0.25 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 121.423 0.63 . . . . 73.409999999999997 110.449 175.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . 0.561 ' O ' ' HA ' ' A' ' 149' ' ' PHE . 38.6 m80 -72.38 86.03 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.828 0.677 . . . . 71.150000000000006 112.828 -169.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 20.0 t60 -84.6 -8.53 58.86 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.658 0.742 . . . . 74.150000000000006 109.352 169.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -146.18 150.09 35.19 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.118 -0.946 . . . . 71.299999999999997 110.206 172.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 26.5 t60 . . . . . 0 C--O 1.254 1.307 0 CA-C-O 118.551 -0.737 . . . . 74.150000000000006 111.596 -179.701 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.398 0.618 . . . . 75.010000000000005 110.764 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.19 178.19 8.96 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 115.646 -0.706 . . . . 60.450000000000003 111.433 -175.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -91.11 158.64 16.53 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 115.969 -0.56 . . . . 65.230000000000004 111.547 176.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -55.46 -37.27 67.54 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.394 0.616 . . . . 75.140000000000001 109.928 172.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.87 -41.47 74.45 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.545 -0.752 . . . . 65.25 111.554 174.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -67.41 -39.97 85.56 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.93 0.395 . . . . 71.450000000000003 110.565 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 24.0 mmm180 -67.18 -42.74 83.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.333 -0.394 . . . . 74.409999999999997 111.539 176.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.46 ' O ' HG13 ' A' ' 12' ' ' ILE . 48.1 tt0 -61.61 -52.25 65.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.836 0.351 . . . . 64.140000000000001 111.222 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 p -58.86 -52.4 65.88 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.156 -0.475 . . . . 61.100000000000001 111.253 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' HG2' ' A' ' 123' ' ' GLU . 46.1 tp -54.55 -44.4 72.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 116.17 -0.468 . . . . 73.329999999999998 111.54 176.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.415 ' HG2' ' N ' ' A' ' 31' ' ' GLY . 5.3 tp10 -58.02 -51.03 71.37 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.114 0.483 . . . . 72.420000000000002 111.402 178.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 8' ' ' GLN . 75.0 mt -59.59 -52.41 61.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.182 -0.463 . . . . 75.400000000000006 111.34 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 17' ' ' LEU . 71.5 mt -62.62 -43.52 98.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 116.133 -0.485 . . . . 72.109999999999999 111.751 -178.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.461 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 29.3 t -56.04 -54.87 39.73 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 120.966 0.412 . . . . 70.519999999999996 111.929 179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' HD2' ' SD ' ' A' ' 30' ' ' MET . 85.5 mtt-85 -68.3 -34.35 75.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.543 -0.299 . . . . 61.409999999999997 111.326 -178.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.401 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 48.7 t80 -59.71 -50.92 71.95 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.904 0.383 . . . . 73.239999999999995 111.332 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.8 mp -60.64 -37.94 83.14 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 122.288 -0.258 . . . . 75.530000000000001 111.488 178.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 14' ' ' SER . 49.8 mmm-85 -65.71 -56.71 10.64 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 111.875 0.324 . . . . 75.209999999999994 111.875 178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 10.5 pt-20 -57.17 -39.13 74.71 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-O 120.989 0.424 . . . . 70.140000000000001 112.085 -178.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 16' ' ' TYR . 35.5 mm-40 -68.03 -37.27 81.18 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.827 0.346 . . . . 75.329999999999998 111.303 177.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.23 -36.07 61.36 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.37 0.508 . . . . 54.0 112.37 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.416 HG22 ' HE3' ' A' ' 110' ' ' LYS . 71.9 p -85.8 -37.0 19.74 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-O 120.798 0.333 . . . . 65.209999999999994 111.669 -175.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.71 60.94 Favored Glycine 0 CA--C 1.525 0.659 0 C-N-CA 121.098 -0.572 . . . . 74.340000000000003 112.487 -177.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -146.76 144.5 29.43 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.856 0.36 . . . . 54.340000000000003 111.162 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.483 ' HD3' ' NH2' ' A' ' 45' ' ' ARG . 17.9 mmmt -72.82 151.94 41.78 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.622 0.725 . . . . 64.349999999999994 112.732 -178.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -70.9 175.08 5.36 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 114.758 -1.11 . . . . 72.530000000000001 111.659 -179.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 8.0 t -102.05 5.33 40.5 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.525 0.679 . . . . 71.299999999999997 110.5 172.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 86.7 mttt -109.24 143.45 27.73 Favored Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 115.709 -0.678 . . . . 65.030000000000001 112.18 -170.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -80.03 179.84 5.88 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.059 2.506 . . . . 63.530000000000001 113.137 -178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.649 ' SD ' HD22 ' A' ' 41' ' ' LEU . 88.1 mmm -92.47 -170.1 2.4 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 112.396 0.517 . . . . 73.129999999999995 112.396 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.415 ' N ' ' HG2' ' A' ' 11' ' ' GLU . . . -69.68 -176.22 15.78 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-N 116.102 -0.499 . . . . 52.5 114.192 -177.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.445 ' HD2' HH11 ' A' ' 32' ' ' ARG . 57.2 mtt180 -63.87 -15.04 58.0 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.821 0.674 . . . . 61.109999999999999 112.821 -175.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 26.1 m -82.38 -1.65 50.56 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.84 0.311 . . . . 73.150000000000006 111.84 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 47.96 -102.08 0.05 OUTLIER Glycine 0 CA--C 1.529 0.908 0 N-CA-C 114.659 0.623 . . . . 61.409999999999997 114.659 172.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.23 -49.73 73.32 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.535 0.569 . . . . 53.210000000000001 112.535 -175.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.437 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . 89.1 m -57.25 -46.34 83.12 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.931 0.396 . . . . 71.109999999999999 111.422 -179.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.406 ' HA ' HD11 ' A' ' 12' ' ' ILE . 22.7 p -70.47 -30.98 67.94 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.532 -0.304 . . . . 74.099999999999994 111.779 179.438 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -70.76 -56.14 7.04 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.656 0.243 . . . . 61.100000000000001 111.656 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.579 ' HG3' HG21 ' A' ' 147' ' ' VAL . 51.2 pttt -60.08 -37.26 79.37 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 120.739 0.304 . . . . 74.409999999999997 111.181 -179.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.65 -46.76 89.08 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.714 0.292 . . . . 44.420000000000002 111.152 175.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.649 HD22 ' SD ' ' A' ' 30' ' ' MET . 52.4 tp -56.82 -54.1 50.24 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 120.993 0.425 . . . . 73.239999999999995 112.039 179.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 11.9 pt-20 -71.34 -26.4 62.81 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 112.332 0.493 . . . . 64.340000000000003 112.332 -176.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 47' ' ' VAL . 96.3 m -72.35 -36.47 68.81 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.976 -0.452 . . . . 73.019999999999996 110.734 173.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 29.1 mt -54.25 -49.92 68.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.049 0.389 . . . . 73.450000000000003 112.049 176.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.483 ' NH2' ' HD3' ' A' ' 25' ' ' LYS . 5.6 ptp180 -62.35 -42.36 99.33 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 112.424 0.527 . . . . 72.5 112.424 -176.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -72.69 -33.07 66.26 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.364 0.505 . . . . 73.310000000000002 112.364 -174.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -93.99 -29.64 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 CA-C-O 120.911 0.386 . . . . 70.140000000000001 111.721 177.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -77.04 -50.57 6.75 Favored Glycine 0 CA--C 1.522 0.497 0 CA-C-N 116.229 -0.442 . . . . 72.450000000000003 113.936 -174.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -53.02 -45.78 68.13 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 117.11 0.455 . . . . 61.039999999999999 111.406 -176.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.58 -47.44 90.03 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 121.105 -0.569 . . . . 75.120000000000005 112.839 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 47' ' ' VAL . 75.9 t -57.77 -45.05 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 120.86 0.362 . . . . 64.109999999999999 110.905 176.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 26.8 mt-30 -56.32 -41.62 76.32 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.214 -0.448 . . . . 74.019999999999996 111.156 176.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 56.7 mtp180 -67.42 -47.7 69.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.382 0.512 . . . . 61.020000000000003 112.382 -178.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -70.82 -32.83 70.02 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 121.283 0.563 . . . . 71.319999999999993 111.425 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -81.42 -18.37 45.64 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.247 -0.433 . . . . 74.25 112.077 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 35.1 tt0 -48.84 -43.56 38.71 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.578 0.585 . . . . 72.109999999999999 112.578 -175.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 10.0 t -55.2 -34.67 64.11 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.928 0.394 . . . . 74.430000000000007 111.608 178.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.77 -41.37 21.27 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 116.368 -0.378 . . . . 63.210000000000001 111.799 177.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -64.7 -40.87 96.12 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 111.96 0.356 . . . . 63.149999999999999 111.96 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 79.8 mm-40 -54.37 -36.31 63.75 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.8 0.333 . . . . 71.230000000000004 111.344 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.57 -31.7 63.87 Favored Glycine 0 CA--C 1.526 0.756 0 CA-C-N 116.188 -0.46 . . . . 74.530000000000001 112.834 177.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 59.1 mtm -89.27 -43.82 10.69 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.72 0.295 . . . . 54.119999999999997 111.019 176.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mp -53.07 -34.24 55.66 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.236 0.458 . . . . 73.439999999999998 112.236 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -66.09 -28.99 69.24 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 112.105 0.409 . . . . 73.329999999999998 112.105 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -9.24 23.15 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.121 0.486 . . . . 73.329999999999998 111.273 176.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.1 mt -89.58 -74.87 0.46 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.31 -0.405 . . . . 75.310000000000002 111.155 175.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.2 t70 34.29 91.03 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.951 0.9 . . . . 72.349999999999994 112.249 -173.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.49 ' N ' HD12 ' A' ' 68' ' ' ILE . 1.7 mp -64.3 104.21 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 CA-C-N 115.87 -0.605 . . . . 64.430000000000007 111.888 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -99.73 -6.15 27.57 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 116.138 -0.483 . . . . 71.239999999999995 111.697 176.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.439 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.13 164.72 30.43 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.766 0.317 . . . . 64.040000000000006 111.324 173.67 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.95 -30.66 64.25 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.381 0.512 . . . . 62.229999999999997 112.381 -176.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.65 -36.7 64.85 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.095 0.405 . . . . 74.409999999999997 112.095 177.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 54.7 m-20 -62.69 -43.15 99.55 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.03 0.443 . . . . 71.400000000000006 110.409 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.3 t -58.25 -48.22 85.39 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 116.029 -0.532 . . . . 54.329999999999998 111.014 177.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -59.83 -33.22 71.48 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.068 0.461 . . . . 74.340000000000003 111.095 175.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 47.1 t -70.12 -34.25 72.85 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.387 -0.37 . . . . 61.149999999999999 111.375 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.423 ' O ' ' HG2' ' A' ' 81' ' ' MET . 91.8 mt -58.35 -32.74 68.81 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-O 120.679 0.276 . . . . 72.219999999999999 111.111 176.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 82' ' ' ILE . 33.2 t -52.76 -35.48 56.45 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.014 0.435 . . . . 65.120000000000005 111.167 176.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -63.63 -46.46 85.61 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.992 0.425 . . . . 74.439999999999998 110.57 177.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 84' ' ' VAL . 60.1 t -58.22 -43.07 85.03 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.396 -0.366 . . . . 75.209999999999994 110.629 175.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.423 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 22.3 mmt -56.58 -38.79 72.48 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.855 -0.611 . . . . 72.519999999999996 111.84 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 78' ' ' SER . 55.2 mt -65.1 -36.49 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.169 0.509 . . . . 51.109999999999999 110.95 175.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.85 -27.76 60.4 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.246 -0.434 . . . . 72.340000000000003 112.103 177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 80' ' ' VAL . 70.8 t -52.2 -34.85 18.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 CA-C-O 120.859 0.362 . . . . 71.530000000000001 111.304 177.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.481 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 60.6 m-85 -81.38 29.6 0.36 Allowed 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 112.408 0.521 . . . . 74.340000000000003 112.408 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.2 t -84.91 4.14 34.86 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.98 -0.45 . . . . 71.209999999999994 111.958 179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -55.6 -62.09 1.92 Allowed 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.166 0.508 . . . . 73.010000000000005 112.343 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 109.67 -38.49 3.29 Favored Glycine 0 CA--C 1.527 0.789 0 CA-C-N 115.911 -0.586 . . . . 41.420000000000002 112.183 -172.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 9.1 p -83.82 132.15 32.17 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 CA-C-O 121.321 0.582 . . . . 72.439999999999998 111.6 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 75.1 p -91.68 52.69 2.08 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.55 0.574 . . . . 75.439999999999998 112.55 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.411 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.9 OUTLIER -97.83 143.18 28.71 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 122.186 -0.321 . . . . 74.140000000000001 110.926 174.672 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -57.03 -21.29 29.96 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 112.608 0.596 . . . . 71.109999999999999 112.608 -177.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.55 52.98 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 121.185 -0.531 . . . . 70.140000000000001 113.309 177.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' A' ' 91' ' ' ASN . 6.9 ptm180 -70.24 -30.63 67.74 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 120.97 0.414 . . . . 54.310000000000002 111.264 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 45.5 mm -66.36 -39.23 83.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-O 121.275 0.56 . . . . 61.350000000000001 109.622 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.02 -47.7 89.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.593 -0.731 . . . . 72.040000000000006 110.775 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.1 m -53.4 -45.81 69.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 111.873 0.323 . . . . 74.219999999999999 111.873 178.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.481 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 40.3 tp -61.23 -55.1 35.91 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.162 0.505 . . . . 71.030000000000001 111.909 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.0 mt -68.73 -38.82 79.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 CA-C-N 116.262 -0.426 . . . . 52.409999999999997 111.75 -176.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.9 p -65.1 -45.41 85.32 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.285 -0.416 . . . . 72.340000000000003 111.048 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.421 ' O ' HG23 ' A' ' 105' ' ' VAL . 25.1 t80 -56.74 -40.57 75.99 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.762 0.315 . . . . 62.340000000000003 110.781 174.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.46 -48.34 84.71 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 121.037 -0.601 . . . . 62.329999999999998 112.457 174.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 17' ' ' LEU . . . -65.74 -32.35 73.85 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.886 0.374 . . . . 71.200000000000003 111.584 177.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -64.73 -46.85 80.51 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.974 0.416 . . . . 74.420000000000002 110.688 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.465 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 61.1 t -65.74 -36.77 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-N 116.347 -0.388 . . . . 63.329999999999998 110.227 175.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.91 -46.94 78.28 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.126 -0.488 . . . . 61.439999999999998 111.847 177.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -54.78 -47.6 73.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.416 0.627 . . . . 64.120000000000005 110.601 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.488 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.9 t60 -63.17 -36.71 84.52 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.714 -0.675 . . . . 74.120000000000005 111.31 177.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 73.9 mt -63.61 -51.07 66.87 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 111.634 0.235 . . . . 74.120000000000005 111.634 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.416 ' HE3' HG22 ' A' ' 22' ' ' THR . 65.9 tttm -61.25 -38.61 87.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.151 0.501 . . . . 64.439999999999998 110.507 179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 93.7 m -57.84 -45.94 85.5 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 115.853 -0.612 . . . . 65.439999999999998 111.397 176.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 108' ' ' HIS . 29.4 pt -88.22 22.09 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 120.752 0.31 . . . . 74.340000000000003 111.789 178.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.634 HD22 ' N ' ' A' ' 113' ' ' ASN . 0.7 OUTLIER 69.34 14.14 8.49 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 112.885 0.698 . . . . 64.430000000000007 112.885 173.106 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -100.78 37.24 1.76 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.167 0.432 . . . . 75.439999999999998 112.167 -179.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.517 ' HG3' HD12 ' A' ' 118' ' ' ILE . 43.3 tt0 -60.2 -34.27 73.4 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.928 -0.482 . . . . 74.540000000000006 111.86 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.2 m -57.02 -28.93 62.92 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 122.177 -0.327 . . . . 65.319999999999993 111.843 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.7 m -73.48 -26.81 61.07 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.078 0.399 . . . . 63.439999999999998 112.078 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.517 HD12 ' HG3' ' A' ' 115' ' ' GLU . 66.2 mt -55.2 -45.92 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 112.772 0.656 . . . . 44.25 112.772 -177.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.81 -52.38 42.3 Favored Pre-proline 0 CA--C 1.549 0.925 0 N-CA-C 112.693 0.627 . . . . 54.520000000000003 112.693 -174.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -59.04 -27.87 86.24 Favored 'Trans proline' 0 C--N 1.356 0.948 0 C-N-CA 121.568 1.512 . . . . 72.430000000000007 112.354 173.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.416 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.8 tt -64.73 -44.95 88.49 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.837 -0.431 . . . . 72.25 109.837 173.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.512 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.26 -40.54 82.08 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.057 0.456 . . . . 70.099999999999994 111.099 174.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.511 ' HG2' HD11 ' A' ' 10' ' ' LEU . 32.3 mt-10 -63.09 -36.63 84.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.088 -0.506 . . . . 74.219999999999999 111.119 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.2 m -65.27 -44.24 88.69 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 116.595 -0.275 . . . . 71.530000000000001 111.287 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 121' ' ' LEU . 48.7 mm -53.98 -53.13 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.131 0.491 . . . . 63.130000000000003 110.61 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 25.4 m -62.93 -39.84 95.81 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.669 -0.696 . . . . 74.209999999999994 111.625 179.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -54.35 -51.61 64.22 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.419 -0.355 . . . . 64.140000000000001 111.173 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.448 ' O ' HG22 ' A' ' 132' ' ' THR . 58.8 t -68.36 -46.27 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 CA-C-N 116.296 -0.411 . . . . 60.109999999999999 111.13 177.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.581 ' HG ' HD11 ' A' ' 137' ' ' LEU . 44.1 tp -51.56 -52.8 44.27 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.848 -0.615 . . . . 72.340000000000003 111.89 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 66.0 t -76.06 -32.19 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 116.194 -0.457 . . . . 45.329999999999998 111.861 -178.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -56.19 -39.38 72.34 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.042 0.386 . . . . 73.310000000000002 112.042 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.448 HG22 ' O ' ' A' ' 128' ' ' VAL . 2.5 t -104.57 -42.64 5.37 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.886 0.699 . . . . 63.299999999999997 112.886 -177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.404 ' HD3' HG23 ' A' ' 132' ' ' THR . 12.4 mptt -102.47 26.12 8.23 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 112.681 0.623 . . . . 54.409999999999997 112.681 -176.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 1.1 tpm_? -45.28 -53.08 8.86 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.088 0.555 . . . . 74.310000000000002 112.256 175.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 139' ' ' LYS . 3.9 m-20 -69.6 -52.19 28.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 73.340000000000003 111.779 -175.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -58.85 -37.94 77.61 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.06 0.392 . . . . 73.439999999999998 112.06 -176.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.581 HD11 ' HG ' ' A' ' 129' ' ' LEU . 34.1 mt -54.79 -51.51 65.55 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.037 0.384 . . . . 75.400000000000006 112.037 178.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.446 ' HB ' HH21 ' A' ' 134' ' ' ARG . 14.8 p -79.0 -36.56 18.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 112.441 0.534 . . . . 72.519999999999996 112.441 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 135' ' ' ASP . 73.9 mmtt -65.52 -45.71 82.44 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 112.286 0.476 . . . . 64.430000000000007 112.286 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -102.32 7.05 40.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.619 0.247 . . . . 74.530000000000001 111.561 -176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 58.4 mtm180 52.81 71.79 0.46 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 116.27 -0.423 . . . . 64.439999999999998 110.802 -176.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -49.62 -44.91 38.42 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 114.638 0.615 . . . . 74.120000000000005 114.638 -172.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -75.29 -20.02 59.35 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 112.447 0.536 . . . . 63.409999999999997 112.447 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -84.28 -51.06 7.29 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 120.897 0.379 . . . . 75.450000000000003 110.327 171.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -54.3 -40.31 67.69 Favored Glycine 0 CA--C 1.526 0.775 0 CA-C-N 115.961 -0.563 . . . . 23.140000000000001 113.153 177.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -56.35 -53.46 57.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 122.704 0.402 . . . . 60.439999999999998 111.894 175.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.579 HG21 ' HG3' ' A' ' 39' ' ' LYS . 80.0 t -64.22 -42.73 96.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.002 0.43 . . . . 53.25 111.988 -177.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.489 ' HB2' ' HB3' ' A' ' 154' ' ' ASP . 12.8 pt-20 -73.91 -27.81 61.23 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 111.911 0.337 . . . . 60.439999999999998 111.911 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -56.15 -46.35 79.29 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.194 0.521 . . . . 73.230000000000004 111.464 178.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -82.48 4.0 26.07 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 116.132 -0.485 . . . . 62.450000000000003 111.553 176.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 15.8 m170 56.52 54.44 7.47 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.806 0.669 . . . . 74.209999999999994 112.806 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 56.0 t -83.98 -33.47 9.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.255 0.55 . . . . 71.349999999999994 109.873 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -117.0 -64.06 1.36 Allowed 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.763 -0.653 . . . . 70.099999999999994 111.538 176.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.489 ' HB3' ' HB2' ' A' ' 148' ' ' GLU . 18.0 t70 -57.6 151.53 16.88 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.277 0.56 . . . . 74.25 112.491 -178.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.579 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -126.92 23.92 6.53 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 116.03 -0.532 . . . . 73.299999999999997 112.315 -176.48 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -134.08 -67.19 0.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.161 0.505 . . . . 75.530000000000001 111.657 176.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -77.65 87.61 1.04 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 114.499 0.56 . . . . 74.049999999999997 114.499 -172.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -138.89 25.97 2.77 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 111.708 -0.557 . . . . 75.140000000000001 111.708 174.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -69.59 91.54 0.6 Allowed 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.357 0.663 . . . . 75.310000000000002 112.179 -173.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 80.1 t60 -154.13 129.88 10.07 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.402 . . . . 74.030000000000001 111.793 178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 9.7 m170 -120.37 165.61 14.66 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.17 0.51 . . . . 74.030000000000001 111.513 175.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -116.12 99.08 6.99 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.098 -0.501 . . . . 71.310000000000002 111.064 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -77.52 144.55 37.57 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.13 0.49 . . . . 71.109999999999999 111.53 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 41.8 t60 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.781 -0.628 . . . . 64.209999999999994 110.83 173.598 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.1 tpt . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.998 0.428 . . . . 73.510000000000005 111.062 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -112.87 177.15 4.73 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.065 -0.516 . . . . 75.239999999999995 111.761 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -91.95 162.93 14.19 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 116.374 -0.375 . . . . 72.150000000000006 111.446 -178.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.18 -47.83 80.24 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.254 0.549 . . . . 71.519999999999996 111.472 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.1 tp -68.05 -36.54 80.05 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.804 -0.635 . . . . 64.299999999999997 110.704 179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -63.39 -51.55 65.36 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.842 -0.617 . . . . 71.530000000000001 110.523 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 7' ' ' ARG . 7.4 tpt180 -65.47 -40.78 93.58 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 111.726 0.269 . . . . 64.310000000000002 111.726 -174.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -57.62 -52.94 63.37 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 120.996 0.427 . . . . 72.319999999999993 110.968 174.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.06 -40.57 94.16 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.001 -0.545 . . . . 71.219999999999999 110.755 178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.502 HD13 ' HA ' ' A' ' 123' ' ' GLU . 42.1 tp -59.48 -44.83 92.96 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.958 -0.565 . . . . 43.509999999999998 111.518 178.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.504 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 42.7 tt0 -64.91 -50.34 66.89 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.748 0.309 . . . . 71.219999999999999 110.982 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 69.7 mt -56.5 -48.03 80.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 120.884 0.373 . . . . 74.019999999999996 111.374 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.469 ' O ' HD13 ' A' ' 17' ' ' LEU . 81.0 mt -64.8 -44.67 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-N 116.492 -0.322 . . . . 64.400000000000006 111.43 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 38.5 t -53.96 -50.96 65.33 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 120.954 0.407 . . . . 74.150000000000006 111.109 177.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 11' ' ' GLU . 61.7 mtt-85 -61.26 -49.19 78.07 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.225 -0.443 . . . . 74.340000000000003 111.105 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.404 ' HE1' ' HA ' ' A' ' 45' ' ' ARG . 20.1 t80 -53.95 -50.85 65.57 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.069 0.396 . . . . 64.230000000000004 112.069 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 13' ' ' ILE . 9.6 mp -55.77 -46.82 77.83 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.947 0.404 . . . . 74.219999999999999 111.352 178.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 14' ' ' SER . 35.2 mtp180 -66.02 -53.57 36.86 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.07 0.396 . . . . 73.329999999999998 112.07 -179.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.531 ' CD ' HH21 ' A' ' 45' ' ' ARG . 15.1 pt-20 -62.59 -31.04 71.79 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 111.883 0.327 . . . . 72.340000000000003 111.883 -179.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.626 ' HG2' HE22 ' A' ' 52' ' ' GLN . 0.1 OUTLIER -75.57 -27.92 58.77 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.936 0.398 . . . . 71.030000000000001 111.241 179.385 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -84.69 -40.7 17.06 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-O 120.945 0.402 . . . . 74.340000000000003 111.708 176.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.408 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 44.2 p -87.39 -37.19 17.28 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.003 0.43 . . . . 73.310000000000002 111.955 -177.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.53 10.48 55.56 Favored Glycine 0 CA--C 1.529 0.937 0 C-N-CA 121.263 -0.494 . . . . 32.409999999999997 112.767 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -142.19 126.0 17.08 Favored 'General case' 0 N--CA 1.469 0.489 0 O-C-N 122.546 -0.384 . . . . 54.219999999999999 111.957 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -67.03 170.46 6.79 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.15 0.5 . . . . 64.540000000000006 111.759 177.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -80.38 153.7 28.16 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.189 0.519 . . . . 62.409999999999997 111.826 176.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 10.4 t -94.76 31.68 1.77 Allowed 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.868 0.842 . . . . 64.099999999999994 110.225 175.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -111.88 158.19 37.42 Favored Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.511 -0.768 . . . . 73.219999999999999 111.671 -175.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.69 155.82 46.25 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.534 2.156 . . . . 73.400000000000006 112.671 173.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 89.5 mmm -84.8 -177.47 6.59 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.186 0.517 . . . . 74.420000000000002 112.159 -179.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -68.1 179.15 19.82 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 114.515 0.566 . . . . 72.420000000000002 114.515 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.69 -24.76 2.44 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 114.222 1.193 . . . . 74.120000000000005 114.222 -173.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 m -83.23 -29.63 28.34 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 122.059 -0.401 . . . . 65.200000000000003 112.065 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 76.9 -100.37 1.46 Allowed Glycine 0 CA--C 1.528 0.898 0 C-N-CA 120.841 -0.695 . . . . 73.5 112.443 -174.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -50.63 69.42 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.136 0.421 . . . . 71.450000000000003 112.136 -176.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 85.0 m -60.06 -33.62 72.31 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.008 0.432 . . . . 73.519999999999996 111.176 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 38.9 t -68.89 -40.99 78.87 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.38 -0.373 . . . . 64.129999999999995 111.15 178.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.7 ttp180 -62.61 -50.32 71.72 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.42 0.629 . . . . 63.0 110.539 175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.458 ' HE3' ' HB2' ' A' ' 153' ' ' GLU . 55.2 mtpt -57.78 -45.4 86.04 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.165 -0.925 . . . . 71.409999999999997 111.829 -178.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.439 ' HB2' ' HB3' ' A' ' 143' ' ' TRP . . . -59.4 -49.94 75.89 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.932 0.396 . . . . 62.43 111.383 177.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 60.9 tp -60.52 -52.6 64.52 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.268 -0.424 . . . . 71.200000000000003 111.862 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -61.02 -32.95 72.54 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.784 0.326 . . . . 50.109999999999999 111.589 -176.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.499 ' O ' HG22 ' A' ' 47' ' ' VAL . 83.4 m -73.57 -41.4 62.97 Favored 'General case' 0 N--CA 1.468 0.426 0 O-C-N 122.269 -0.27 . . . . 60.340000000000003 110.836 177.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 35.8 mt -54.34 -45.64 72.73 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.142 0.423 . . . . 62.149999999999999 112.142 178.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.531 HH21 ' CD ' ' A' ' 19' ' ' GLU . 12.5 ptp180 -65.02 -42.26 94.56 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 122.169 -0.332 . . . . 74.109999999999999 111.705 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 46' ' ' ARG . 13.8 ttm180 -68.43 -45.29 72.98 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.921 0.341 . . . . 64.219999999999999 111.921 -176.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 21.0 m -86.32 -31.01 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 120.908 0.385 . . . . 70.5 111.709 -179.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.38 -43.98 94.1 Favored Glycine 0 CA--C 1.523 0.577 0 C-N-CA 121.321 -0.466 . . . . 70.299999999999997 112.944 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.499 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 17.9 t70 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-O 120.881 0.372 . . . . 72.430000000000007 110.823 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.4 -46.42 80.41 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 121.307 -0.473 . . . . 52.520000000000003 112.966 178.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 96.2 t -58.66 -42.32 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 120.871 0.367 . . . . 63.210000000000001 111.168 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.626 HE22 ' HG2' ' A' ' 20' ' ' GLN . 79.0 mt-30 -63.25 -43.01 99.22 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 116.27 -0.423 . . . . 71.219999999999999 111.924 179.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 45.3 mtm-85 -58.2 -45.35 87.77 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 121.014 0.435 . . . . 70.010000000000005 111.611 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.0 m-20 -73.87 -45.33 51.62 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 121.212 0.529 . . . . 72.349999999999994 111.656 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -77.27 -16.16 59.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.228 0.825 . . . . 63.439999999999998 113.228 -176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -46.87 -52.18 14.99 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.029 0.752 . . . . 74.230000000000004 113.029 -172.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.7 t -60.29 -30.62 69.58 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.022 0.379 . . . . 54.340000000000003 112.022 -178.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -77.74 -50.94 11.37 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.983 0.421 . . . . 74.120000000000005 111.45 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -60.46 -42.26 95.8 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.167 0.432 . . . . 72.5 112.167 -178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -51.43 -39.88 58.25 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 111.955 0.354 . . . . 74.450000000000003 111.955 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -57.94 -34.74 72.96 Favored Glycine 0 CA--C 1.526 0.75 0 C-N-CA 121.289 -0.481 . . . . 64.019999999999996 113.253 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.485 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 49.1 mtm -89.77 -35.23 15.84 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.335 0.588 . . . . 63.210000000000001 110.314 177.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.555 HD21 ' HB2' ' A' ' 108' ' ' HIS . 14.7 tp -56.99 -42.41 80.2 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.616 -0.72 . . . . 64.019999999999996 111.793 -175.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.0 ptp180 -68.15 -15.47 63.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.961 0.726 . . . . 73.140000000000001 112.961 -177.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.55 0.74 19.32 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 121.24 0.543 . . . . 73.129999999999995 111.225 174.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 62' ' ' MET . 94.8 mt -96.23 -69.7 0.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 116.036 -0.529 . . . . 73.219999999999999 110.705 173.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 69.63 -52.08 0.62 Allowed 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 113.649 0.981 . . . . 62.340000000000003 113.649 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.436 HD11 HD21 ' A' ' 77' ' ' LEU . 2.4 mp 64.94 99.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 C-N-CA 123.483 0.713 . . . . 65.310000000000002 111.478 -174.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.09 -14.89 13.82 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.306 -0.406 . . . . 72.439999999999998 112.019 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -150.56 173.45 14.09 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.625 0.25 . . . . 63.109999999999999 110.946 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -56.77 -35.48 68.71 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.557 0.577 . . . . 74.209999999999994 112.557 -176.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -54.29 -42.26 69.86 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 122.311 -0.243 . . . . 62.520000000000003 111.472 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.423 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 44.3 m-20 -63.29 -43.54 97.6 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.094 0.473 . . . . 52.340000000000003 110.559 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.3 t -57.99 -46.7 87.78 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 115.932 -0.576 . . . . 75.400000000000006 111.189 176.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 92.5 mttt -69.61 -28.57 66.05 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 120.895 0.379 . . . . 70.150000000000006 111.481 177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 74.7 m -68.33 -32.04 71.87 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 120.912 0.387 . . . . 64.340000000000003 110.778 174.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.475 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.6 mt -59.73 -34.26 72.71 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.732 0.301 . . . . 71.099999999999994 110.852 174.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.456 ' O ' HG13 ' A' ' 82' ' ' ILE . 43.1 t -52.64 -35.73 55.33 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 116.27 -0.423 . . . . 63.130000000000003 111.576 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -58.25 -42.3 86.12 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.975 0.417 . . . . 74.430000000000007 110.969 177.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 65.9 t -73.46 -39.25 54.43 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.136 0.494 . . . . 73.409999999999997 110.845 176.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 98' ' ' LEU . 18.2 mmt -56.74 -39.92 74.81 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.04 -0.527 . . . . 74.230000000000004 111.532 -179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 78' ' ' SER . 78.7 mt -60.0 -35.49 61.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-O 120.818 0.342 . . . . 43.109999999999999 111.389 175.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.423 ' HA ' ' OG ' ' A' ' 86' ' ' SER . 61.6 m-70 -65.33 -39.45 92.44 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 120.895 0.378 . . . . 65.519999999999996 111.328 176.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 60.7 t -58.59 -32.83 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-O 120.893 0.378 . . . . 71.310000000000002 111.404 177.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.488 ' CE2' HD22 ' A' ' 98' ' ' LEU . 17.0 m-30 -106.68 24.9 11.93 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.504 0.557 . . . . 63.039999999999999 112.504 178.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.423 ' OG ' ' HA ' ' A' ' 83' ' ' HIS . 71.6 m -78.48 41.6 0.4 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.13 0.49 . . . . 70.409999999999997 111.722 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.444 ' OD1' HG13 ' A' ' 89' ' ' VAL . 6.8 t70 -158.93 170.36 22.28 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 116.451 -0.34 . . . . 64.010000000000005 110.75 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -128.13 15.27 6.17 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 121.08 -0.581 . . . . 70.310000000000002 113.976 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.444 HG13 ' OD1' ' A' ' 87' ' ' ASP . 13.4 m -63.66 139.03 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 CA-C-N 117.52 0.66 . . . . 75.549999999999997 111.857 177.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 29.4 p -78.57 77.14 5.06 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.217 0.532 . . . . 63.140000000000001 111.459 -179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -141.0 113.38 8.04 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.865 -0.607 . . . . 62.310000000000002 110.704 178.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.45 ' HE3' HG13 ' A' ' 95' ' ' ILE . 33.1 m95 -63.9 -17.82 63.59 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.653 0.263 . . . . 73.450000000000003 111.457 178.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -51.97 -37.82 45.64 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 121.589 -0.338 . . . . 64.450000000000003 113.341 177.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 94' ' ' ARG . 22.2 mmt180 -66.31 -40.74 90.14 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 122.491 -0.417 . . . . 73.430000000000007 111.43 176.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.45 HG13 ' HE3' ' A' ' 92' ' ' TRP . 37.2 mm -61.53 -44.47 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 121.274 0.559 . . . . 73.510000000000005 110.062 175.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 92' ' ' TRP . 51.6 t -60.89 -41.15 87.72 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 CA-C-N 115.831 -0.622 . . . . 70.239999999999995 110.963 175.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 93.1 m -55.44 -48.13 74.94 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.747 0.308 . . . . 53.439999999999998 111.277 178.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.557 HD11 ' SD ' ' A' ' 81' ' ' MET . 19.4 tp -62.56 -54.44 39.81 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.148 0.499 . . . . 71.120000000000005 111.501 -179.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.9 mt -64.85 -38.31 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.048 -0.523 . . . . 74.040000000000006 111.497 -177.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -63.21 -45.5 91.41 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 116.223 -0.444 . . . . 64.409999999999997 111.168 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 105' ' ' VAL . 26.5 t80 -61.05 -39.17 88.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 120.735 0.302 . . . . 74.340000000000003 110.568 175.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.13 -47.35 88.25 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 121.022 -0.609 . . . . 51.039999999999999 112.474 174.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.32 -35.57 81.4 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.203 0.525 . . . . 62.5 111.471 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.07 -46.73 87.8 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.023 -0.535 . . . . 70.219999999999999 110.848 177.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 101' ' ' PHE . 46.4 t -65.56 -36.43 77.62 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 116.353 -0.385 . . . . 73.109999999999999 110.613 175.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.06 -39.43 69.2 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.338 -0.392 . . . . 64.430000000000007 111.721 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -58.42 -44.47 89.09 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.226 0.536 . . . . 75.219999999999999 110.932 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.555 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.1 t60 -65.66 -42.62 91.16 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.128 -0.487 . . . . 74.530000000000001 110.701 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.431 HD21 ' HB ' ' A' ' 68' ' ' ILE . 97.5 mt -59.66 -50.36 74.18 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.287 -0.415 . . . . 63.140000000000001 111.086 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.408 ' HE2' ' HA ' ' A' ' 22' ' ' THR . 64.7 tttp -56.26 -43.8 79.07 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 116.282 -0.417 . . . . 74.209999999999994 111.412 178.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.0 m -60.69 -44.04 97.02 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.166 -0.47 . . . . 64.129999999999995 112.011 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.416 HG12 ' O ' ' A' ' 108' ' ' HIS . 34.3 pt -89.68 16.46 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 N-CA-C 112.308 0.484 . . . . 65.120000000000005 112.308 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.603 HD22 ' N ' ' A' ' 113' ' ' ASN . 0.7 OUTLIER 75.98 7.29 3.68 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.007 0.743 . . . . 61.539999999999999 113.007 175.668 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -82.72 33.69 0.43 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 122.551 0.34 . . . . 71.109999999999999 111.645 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.4 ' CD ' HH21 ' A' ' 18' ' ' ARG . 2.4 tm-20 -57.03 -30.76 64.49 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.043 0.449 . . . . 71.209999999999994 111.433 -176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.431 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 58.7 m -69.62 -39.66 77.06 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 122.18 -0.325 . . . . 53.200000000000003 111.636 176.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.6 m -54.69 -26.31 32.78 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.074 0.398 . . . . 64.349999999999994 112.074 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.0 mt -53.89 -39.18 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.839 0 N-CA-C 112.097 0.406 . . . . 70.450000000000003 112.097 177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.23 -54.99 16.74 Favored Pre-proline 0 CA--C 1.552 1.032 0 N-CA-C 112.518 0.562 . . . . 70.040000000000006 112.518 -175.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.431 ' HD2' ' O ' ' A' ' 116' ' ' SER . 20.9 Cg_endo -61.35 -26.85 82.15 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.769 1.646 . . . . 61.450000000000003 112.394 174.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.68 -47.44 75.44 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.776 -0.453 . . . . 74.409999999999997 109.776 174.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.5 -36.81 69.59 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.052 -0.522 . . . . 71.5 111.143 174.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.502 ' HA ' HD13 ' A' ' 10' ' ' LEU . 44.7 mt-10 -63.85 -44.94 91.64 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.353 -0.385 . . . . 73.439999999999998 111.159 176.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 66.2 m -60.77 -45.25 95.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 120.786 0.326 . . . . 64.230000000000004 111.456 177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 48.3 mm -53.76 -52.22 36.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 CA-C-O 121.213 0.53 . . . . 43.200000000000003 110.734 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 24.2 m -66.32 -33.39 75.62 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.928 -0.578 . . . . 64.439999999999998 111.818 179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -63.27 -51.63 65.34 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.833 0.349 . . . . 73.140000000000001 110.684 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 81' ' ' MET . 60.4 t -64.19 -36.73 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.017 0.437 . . . . 73.230000000000004 111.222 176.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' A' ' 137' ' ' LEU . 61.9 tp -57.51 -52.89 63.57 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 116.158 -0.474 . . . . 73.310000000000002 111.5 176.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 59.8 t -76.55 -24.66 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 116.426 -0.352 . . . . 72.409999999999997 111.658 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -44.74 -52.57 8.23 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.147 0.579 . . . . 74.420000000000002 112.513 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -130.04 -25.26 2.53 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.177 0.806 . . . . 72.109999999999999 113.177 -174.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 129' ' ' LEU . 1.1 mpmm? -85.27 11.39 10.17 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.647 -0.658 . . . . 73.049999999999997 111.847 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.404 ' HD3' HH11 ' A' ' 134' ' ' ARG . 9.0 tpt180 -47.39 -60.65 2.37 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 112.645 0.609 . . . . 64.519999999999996 112.645 -179.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -64.93 -37.81 88.88 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.791 0.329 . . . . 64.019999999999996 111.752 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -62.58 -38.98 92.21 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 120.751 0.31 . . . . 71.109999999999999 111.484 178.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.57 HD11 ' HG ' ' A' ' 129' ' ' LEU . 72.2 mt -59.79 -49.58 77.17 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.803 0.335 . . . . 44.210000000000001 111.67 179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.9 p -75.44 -40.13 41.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 112.037 0.384 . . . . 61.130000000000003 112.037 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 36.4 mmtm -68.29 -44.09 76.25 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.386 0.513 . . . . 64.310000000000002 112.386 -178.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 28.3 mm-40 -88.66 5.69 41.91 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 120.861 0.362 . . . . 71.109999999999999 110.99 177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 47.0 mtt180 59.57 29.28 18.83 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.084 0.554 . . . . 75.420000000000002 112.164 177.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.43 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 18.24 -86.93 0.0 OUTLIER Glycine 0 C--N 1.339 0.743 0 N-CA-C 115.917 1.127 . . . . 63.32 115.917 175.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.557 ' O ' HG23 ' A' ' 147' ' ' VAL . 14.1 m95 -75.09 -34.46 61.75 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.823 0.675 . . . . 70.209999999999994 112.823 -171.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -63.84 -52.49 59.88 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 121.04 0.448 . . . . 62.149999999999999 110.305 174.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -64.51 -35.6 92.14 Favored Glycine 0 CA--C 1.526 0.778 0 CA-C-N 115.863 -0.608 . . . . 50.130000000000003 112.718 178.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -55.17 -48.72 73.36 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.041 0.536 . . . . 64.420000000000002 111.998 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.4 t -65.1 -45.23 94.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 112.317 0.488 . . . . 62.32 112.317 -176.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.415 ' HA ' ' HB3' ' A' ' 154' ' ' ASP . 6.6 pt-20 -73.92 -27.46 61.04 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 122.143 -0.348 . . . . 64.439999999999998 111.872 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -57.09 -50.29 73.23 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.012 0.434 . . . . 71.25 111.326 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.37 -8.93 59.32 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.171 -0.468 . . . . 71.439999999999998 111.22 175.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 7.6 t60 65.27 71.91 0.43 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.475 0.71 . . . . 63.420000000000002 112.147 176.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.476 HG12 ' HG2' ' A' ' 153' ' ' GLU . 67.1 t -114.07 -63.47 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 CA-C-N 116.109 -0.496 . . . . 64.140000000000001 110.757 175.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.476 ' HG2' HG12 ' A' ' 152' ' ' VAL . 10.8 mm-40 -125.85 70.7 1.21 Allowed 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 116.008 -0.542 . . . . 74.420000000000002 110.091 177.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' A' ' 148' ' ' GLU . 2.8 p-10 -97.81 170.3 9.07 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.678 0.621 . . . . 74.430000000000007 112.678 -175.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.701 ' H ' HD13 ' A' ' 155' ' ' LEU . 0.0 OUTLIER -116.57 -16.57 10.75 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 116.177 -0.465 . . . . 71.340000000000003 112.249 -179.433 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.432 ' N ' HD22 ' A' ' 155' ' ' LEU . 44.5 mt-10 65.68 -13.93 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.593 1.331 . . . . 63.310000000000002 114.593 172.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -72.53 -104.15 0.06 OUTLIER Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.147 -0.549 . . . . 62.420000000000002 113.881 -178.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -89.95 110.77 3.79 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 121.249 -0.501 . . . . 32.409999999999997 112.959 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -171.07 172.36 5.44 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 120.715 0.293 . . . . 75.230000000000004 111.559 -177.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 13.7 m170 -147.65 113.78 5.85 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 112.077 0.399 . . . . 74.25 112.077 178.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -86.6 87.31 7.42 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.962 0.411 . . . . 74.519999999999996 110.614 173.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . 0.545 ' O ' ' HB3' ' A' ' 163' ' ' HIS . 34.8 m80 -71.23 77.21 0.72 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 112.476 0.547 . . . . 71.310000000000002 112.476 -176.342 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . 0.545 ' HB3' ' O ' ' A' ' 162' ' ' HIS . 0.1 OUTLIER 173.38 168.82 0.16 Allowed 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 120.808 0.337 . . . . 72.420000000000002 111.38 173.536 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.8 p80 . . . . . 0 C--O 1.251 1.143 0 CA-C-O 118.722 -0.656 . . . . 75.430000000000007 111.412 172.506 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.407 ' O ' ' HG3' ' A' ' 1' ' ' MET . 21.4 ptm . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.412 0.625 . . . . 74.209999999999994 111.117 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -86.86 128.33 35.05 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.093 -0.503 . . . . 65.019999999999996 111.482 -175.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -55.58 156.61 4.58 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.866 -0.606 . . . . 74.530000000000001 112.179 -179.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -52.02 -45.51 64.62 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 111.414 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 58.6 tp -55.39 -41.81 73.17 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.006 0.373 . . . . 70.049999999999997 112.006 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -66.96 -51.92 49.2 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.869 0.366 . . . . 74.150000000000006 110.694 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 22.0 mmm180 -59.56 -37.12 77.62 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.226 -0.443 . . . . 72.349999999999994 111.284 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.402 ' CD ' ' HB2' ' A' ' 33' ' ' SER . 49.3 tt0 -65.4 -52.1 55.75 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.992 -0.549 . . . . 74.299999999999997 111.482 177.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.1 m -57.32 -48.48 78.86 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 116.283 -0.417 . . . . 73.120000000000005 110.912 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 54.7 tp -60.11 -39.84 87.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 116.315 -0.402 . . . . 73.140000000000001 111.3 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.0 -52.1 66.91 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 116.19 -0.459 . . . . 72.439999999999998 111.526 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 60.1 mt -63.65 -53.14 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 115.964 -0.562 . . . . 72.409999999999997 111.51 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 82.1 mt -63.0 -49.33 83.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.979 -0.555 . . . . 74.129999999999995 112.144 -176.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 t -54.6 -50.82 67.14 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.85 0.357 . . . . 62.140000000000001 111.091 179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 52.2 mtt180 -55.09 -54.71 39.71 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.381 -0.372 . . . . 74.099999999999994 110.602 175.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -52.88 -44.93 67.25 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.547 0.573 . . . . 71.430000000000007 112.547 -175.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.52 HD22 ' HB2' ' A' ' 122' ' ' ALA . 9.3 mp -58.67 -51.43 69.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.643 0.259 . . . . 74.519999999999996 111.529 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -69.47 -26.31 64.51 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 120.75 -0.38 . . . . 72.299999999999997 111.894 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 6.3 mm-40 -64.34 -41.84 96.56 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 121.099 0.476 . . . . 74.329999999999998 110.652 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.607 ' HB3' ' HE3' ' A' ' 107' ' ' LYS . 25.7 mm-40 -72.26 -37.78 69.0 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.982 -0.554 . . . . 65.25 111.995 178.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.7 -43.65 88.51 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.92 0.391 . . . . 54.439999999999998 111.836 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 79.4 p -87.81 -37.81 16.25 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 120.847 0.356 . . . . 74.430000000000007 111.845 -178.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.23 31.13 6.65 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 121.473 -0.394 . . . . 31.140000000000001 113.133 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.08 174.87 5.67 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.099 0.476 . . . . 63.5 112.222 -177.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 ptmm? -143.55 129.91 19.94 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.195 0.521 . . . . 75.430000000000007 111.785 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -105.85 153.15 22.34 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.097 -0.502 . . . . 53.329999999999998 110.857 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.7 t -149.85 11.51 0.75 Allowed 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.925 0.393 . . . . 65.329999999999998 111.841 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -73.23 159.25 85.46 Favored Pre-proline 0 CA--C 1.541 0.617 0 O-C-N 122.265 -0.272 . . . . 75.239999999999995 111.582 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.42 107.15 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.413 2.076 . . . . 61.420000000000002 112.244 174.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 61.6 tpp -65.29 156.32 32.41 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 116.115 -0.493 . . . . 62.219999999999999 112.075 -175.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -77.7 -72.97 1.1 Allowed Glycine 0 CA--C 1.53 1.029 0 N-CA-C 114.27 0.468 . . . . 71.109999999999999 114.27 -175.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.5 tpm_? -63.12 -59.45 4.76 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.587 0.588 . . . . 71.340000000000003 112.587 -173.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.682 ' HB3' ' HB2' ' A' ' 37' ' ' SER . 22.8 t -89.05 -74.67 0.46 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 112.41 0.522 . . . . 74.340000000000003 112.41 -177.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 38' ' ' ARG . . . 122.95 -110.06 1.48 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.344 -0.455 . . . . 55.539999999999999 112.175 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.5 -50.01 66.89 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.215 0.45 . . . . 72.010000000000005 112.215 -177.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.458 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 86.8 m -57.08 -42.25 80.32 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.066 0.46 . . . . 55.520000000000003 111.394 -178.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.682 ' HB2' ' HB3' ' A' ' 33' ' ' SER . 42.7 t -64.26 -43.87 93.51 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.354 -0.385 . . . . 74.019999999999996 111.77 178.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 34' ' ' GLY . 44.3 mtp-105 -65.24 -53.45 44.29 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.771 0.286 . . . . 73.230000000000004 111.771 -179.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HG3' HG21 ' A' ' 147' ' ' VAL . 19.6 ptmt -56.11 -37.51 69.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.103 0.478 . . . . 74.019999999999996 111.049 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.53 -47.3 70.3 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.415 -0.357 . . . . 73.510000000000005 111.213 175.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' HH21 ' A' ' 45' ' ' ARG . 50.2 tp -62.76 -38.54 90.97 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.23 0.456 . . . . 70.329999999999998 112.23 -177.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -75.11 -34.37 61.69 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 120.671 0.272 . . . . 54.210000000000001 111.508 179.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.533 HG23 HG21 ' A' ' 152' ' ' VAL . 88.3 m -75.9 -40.22 54.82 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 111.923 0.342 . . . . 53.109999999999999 111.923 178.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.4 mt -53.53 -35.28 60.54 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.61 0.596 . . . . 54.229999999999997 112.61 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.444 HH21 ' HG ' ' A' ' 41' ' ' LEU . 12.7 ptp180 -77.86 -42.01 34.93 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 122.04 -0.412 . . . . 54.310000000000002 112.097 -177.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.407 ' NH1' HG13 ' A' ' 152' ' ' VAL . 17.0 ptm180 -68.71 -32.53 72.39 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.05 0.389 . . . . 70.219999999999999 112.05 -179.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.437 ' O ' HG23 ' A' ' 51' ' ' VAL . 22.3 m -94.14 -34.77 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 O-C-N 121.978 -0.451 . . . . 74.409999999999997 111.777 176.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.34 -48.8 49.73 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 121.439 -0.41 . . . . 72.420000000000002 113.605 -174.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.563 ' O ' ' HG2' ' A' ' 53' ' ' ARG . 34.6 t70 -63.31 -36.11 82.59 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 122.438 -0.448 . . . . 70.030000000000001 110.778 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.81 -49.96 70.71 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 121.147 -0.549 . . . . 64.439999999999998 112.488 174.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.511 ' HA ' HD21 ' A' ' 54' ' ' ASN . 81.7 t -57.91 -43.26 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-O 120.963 0.411 . . . . 61.439999999999998 111.161 175.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.406 ' O ' ' N ' ' A' ' 56' ' ' GLU . 43.0 mt-30 -54.51 -45.8 73.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 112.074 176.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.563 ' HG2' ' O ' ' A' ' 49' ' ' ASP . 24.3 mmm180 -65.29 -50.01 67.35 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 113.077 0.769 . . . . 61.450000000000003 113.077 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.511 HD21 ' HA ' ' A' ' 51' ' ' VAL . 10.0 p30 -69.72 -30.57 68.22 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.741 -0.599 . . . . 61.409999999999997 110.911 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.3 m-70 -82.13 -18.51 42.64 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.287 -0.415 . . . . 72.530000000000001 112.008 174.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 52' ' ' GLN . 37.1 tt0 -49.84 -48.15 51.21 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 112.325 0.491 . . . . 74.049999999999997 112.325 -173.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.7 t -52.44 -33.73 45.45 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.949 0.404 . . . . 63.240000000000002 111.735 176.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.55 -54.29 5.8 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.295 -0.411 . . . . 62.140000000000001 111.585 178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -56.59 -35.9 68.77 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 112.353 0.501 . . . . 75.439999999999998 112.353 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -56.44 -39.69 73.53 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.953 0.406 . . . . 44.109999999999999 110.91 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.445 ' HA2' ' HE ' ' A' ' 64' ' ' ARG . . . -61.52 -23.24 62.47 Favored Glycine 0 CA--C 1.527 0.785 0 C-N-CA 121.235 -0.507 . . . . 73.230000000000004 112.463 176.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 79.6 mtp -86.72 -55.4 3.88 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 120.706 0.288 . . . . 72.010000000000005 111.177 176.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mp -56.93 -33.15 66.7 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.783 0.66 . . . . 52.530000000000001 112.783 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.445 ' HE ' ' HA2' ' A' ' 61' ' ' GLY . 53.2 ptt85 -64.12 -30.84 71.88 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.941 -0.304 . . . . 74.319999999999993 111.543 178.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.04 -4.04 28.17 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 122.152 -0.343 . . . . 72.030000000000001 111.748 177.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.5 mt -95.95 -71.86 0.66 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 121.068 0.461 . . . . 71.430000000000007 110.532 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.6 t0 44.27 87.73 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.095 0.958 . . . . 72.129999999999995 112.517 -177.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.561 HG23 ' HB2' ' A' ' 73' ' ' ASP . 1.8 mp -70.19 115.41 9.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 CA-C-N 115.881 -0.6 . . . . 74.349999999999994 111.701 -176.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.56 -14.97 13.14 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.394 0.516 . . . . 75.409999999999997 112.394 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -148.52 172.6 14.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.227 -0.296 . . . . 70.120000000000005 111.075 176.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.6 -29.62 70.74 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.354 0.501 . . . . 64.109999999999999 112.354 -175.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -60.59 -39.57 88.59 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.769 0.319 . . . . 71.310000000000002 110.868 178.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.561 ' HB2' HG23 ' A' ' 68' ' ' ILE . 55.6 m-20 -59.65 -40.47 87.78 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-O 121.148 0.499 . . . . 73.239999999999995 110.562 175.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.4 t -58.53 -46.48 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-N 116.068 -0.515 . . . . 71.439999999999998 111.142 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -63.18 -32.43 73.82 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 120.91 0.386 . . . . 74.129999999999995 111.149 177.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -65.48 -37.71 87.61 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.932 0.396 . . . . 55.140000000000001 110.372 174.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -60.01 -37.85 80.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.353 -0.385 . . . . 72.439999999999998 110.964 174.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.9 t -53.48 -42.67 67.48 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 120.957 0.408 . . . . 65.140000000000001 110.851 177.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 mmm-85 -59.91 -46.67 88.61 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.189 -0.459 . . . . 64.329999999999998 110.474 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 61.2 t -58.97 -39.16 77.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-O 120.891 0.377 . . . . 42.420000000000002 111.168 177.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.555 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 18.8 mmt -58.67 -38.02 77.26 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.166 0.508 . . . . 71.230000000000004 110.857 177.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 84.3 mt -58.72 -38.94 74.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 CA-C-N 115.978 -0.555 . . . . 72.239999999999995 110.904 173.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 13.2 m-70 -68.89 -29.74 68.09 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.162 -0.472 . . . . 64.109999999999999 111.493 178.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 82.3 t -63.84 -28.27 44.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-O 120.901 0.381 . . . . 72.450000000000003 111.165 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.523 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 52.4 m-85 -93.81 10.19 34.15 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.452 0.538 . . . . 64.140000000000001 112.452 177.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.8 t -63.52 -46.9 83.93 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 121.17 0.509 . . . . 74.040000000000006 110.961 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -60.67 -70.26 0.19 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 115.705 -0.68 . . . . 73.200000000000003 111.735 176.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.92 54.95 15.45 Favored Glycine 0 CA--C 1.532 1.134 0 N-CA-C 114.524 0.57 . . . . 63.5 114.524 175.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.11 151.7 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 122.128 -0.631 . . . . 75.549999999999997 111.614 171.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 67.4 p -72.82 9.71 1.07 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 113.16 0.8 . . . . 72.299999999999997 113.16 -176.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 50.7 m-80 -76.7 -7.73 55.9 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 111.884 0.327 . . . . 63.5 111.884 177.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 99.9 m95 63.86 -5.06 0.31 Allowed 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.174 0.805 . . . . 70.019999999999996 113.174 -179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -54.78 -24.37 33.02 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.448 -0.406 . . . . 64.019999999999996 112.805 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HE ' ' HA ' ' A' ' 94' ' ' ARG . 2.3 mmp_? -57.47 -44.09 84.56 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.697 0.284 . . . . 73.450000000000003 111.078 174.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 42.8 mm -65.61 -49.96 74.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.026 0.441 . . . . 74.140000000000001 110.994 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.408 HG22 ' CE1' ' A' ' 146' ' ' PHE . 61.6 t -54.29 -52.87 34.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.006 -0.543 . . . . 74.329999999999998 111.276 177.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 91.7 m -58.04 -42.65 85.86 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 111.662 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.523 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 29.5 tp -58.83 -54.98 40.99 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.276 0.56 . . . . 43.310000000000002 111.552 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 54.5 mt -69.97 -35.58 65.0 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 CA-C-N 116.038 -0.528 . . . . 75.120000000000005 111.501 -177.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 68.3 m -65.71 -44.73 85.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.583 -0.28 . . . . 70.430000000000007 111.185 177.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.475 ' O ' HG23 ' A' ' 105' ' ' VAL . 30.8 t80 -61.7 -43.43 98.87 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.676 0.274 . . . . 74.439999999999998 110.809 176.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -58.12 -46.08 93.14 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 120.92 -0.657 . . . . 60.409999999999997 112.481 175.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.17 -34.02 76.65 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.914 0.387 . . . . 65.109999999999999 111.519 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -65.41 -45.72 82.82 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.322 -0.399 . . . . 73.219999999999999 110.703 178.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 46.1 t -66.37 -36.62 77.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 110.085 -0.339 . . . . 54.509999999999998 110.085 175.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.74 -43.72 85.56 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.179 -0.464 . . . . 64.430000000000007 111.534 175.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.607 ' HE3' ' HB3' ' A' ' 20' ' ' GLN . 97.5 mttt -55.42 -46.9 76.63 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 121.328 0.585 . . . . 73.209999999999994 110.716 174.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.412 ' O ' HG12 ' A' ' 112' ' ' ILE . 85.9 t60 -64.7 -34.6 78.7 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.13 -0.487 . . . . 71.549999999999997 111.345 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.527 HD21 ' HB ' ' A' ' 68' ' ' ILE . 80.0 mt -64.45 -49.89 69.66 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.496 0.189 . . . . 75.430000000000007 111.446 178.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.459 ' O ' ' HD3' ' A' ' 110' ' ' LYS . 8.3 tmtm? -57.85 -39.44 77.73 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.209 0.528 . . . . 73.219999999999999 109.802 178.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 73.1 m -60.52 -33.58 72.86 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 116.07 -0.514 . . . . 65.530000000000001 111.817 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 108' ' ' HIS . 33.5 pt -106.28 24.97 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 N-CA-C 112.573 0.582 . . . . 64.239999999999995 112.573 -177.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 63.52 36.77 10.94 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 112.735 0.642 . . . . 62.399999999999999 112.735 175.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -117.32 33.01 5.83 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.746 0.308 . . . . 73.439999999999998 111.705 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -53.16 -30.97 40.2 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.104 0.409 . . . . 60.219999999999999 112.104 178.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.403 ' O ' ' HD2' ' A' ' 120' ' ' PRO . 50.9 m -67.48 -37.12 82.39 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.775 0.321 . . . . 65.040000000000006 111.054 177.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.9 m -65.79 -27.2 68.1 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.093 0.405 . . . . 72.140000000000001 112.093 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.38 -39.28 59.94 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 N-CA-C 112.476 0.547 . . . . 73.109999999999999 112.476 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -66.15 -55.54 20.49 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.604 0.594 . . . . 73.329999999999998 112.604 -176.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.403 ' HD2' ' O ' ' A' ' 116' ' ' SER . 19.2 Cg_endo -59.78 -26.33 81.91 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 121.736 1.624 . . . . 72.5 112.113 174.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 125' ' ' ILE . 6.3 tt -65.29 -48.22 73.89 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 109.811 -0.44 . . . . 63.520000000000003 109.811 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.52 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -59.14 -38.59 80.05 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-O 121.099 0.476 . . . . 73.209999999999994 111.226 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.39 -40.54 96.81 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.206 -0.452 . . . . 53.409999999999997 111.069 174.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 68.9 m -62.1 -46.66 88.07 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.799 0.333 . . . . 73.040000000000006 111.163 177.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 121' ' ' LEU . 45.8 mm -54.75 -51.9 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.283 0.563 . . . . 73.209999999999994 110.97 176.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 32.2 m -66.62 -39.2 88.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.812 -0.631 . . . . 60.240000000000002 111.89 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.603 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 30.5 t70 -59.54 -53.58 56.49 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.78 -0.191 . . . . 75.150000000000006 110.798 -179.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.435 ' O ' HG22 ' A' ' 132' ' ' THR . 62.3 t -61.55 -43.43 96.92 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 CA-C-O 120.908 0.385 . . . . 65.230000000000004 111.044 178.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.636 ' HG ' HD11 ' A' ' 137' ' ' LEU . 35.6 tp -49.6 -52.48 30.05 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.922 -0.581 . . . . 72.219999999999999 111.53 179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.16 -34.51 26.37 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-O 121.332 0.586 . . . . 34.240000000000002 111.387 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.603 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 50.7 ttt180 -58.4 -33.36 69.56 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.831 0.852 . . . . 72.540000000000006 112.872 -174.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.642 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -116.66 -14.36 10.83 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.852 1.056 . . . . 51.340000000000003 113.852 -177.683 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.786 ' HZ2' ' HB3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -150.33 48.9 0.9 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.537 0.94 . . . . 71.25 113.537 174.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . . . . . . . . . 51.0 ttp85 -51.69 -60.53 3.06 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.319 0.489 . . . . 74.109999999999999 112.319 174.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.82 -47.23 85.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.356 -0.384 . . . . 64.420000000000002 111.961 -177.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 133' ' ' LYS . 95.3 m95 -53.32 -38.87 63.6 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 111.873 0.323 . . . . 74.329999999999998 111.873 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.636 HD11 ' HG ' ' A' ' 129' ' ' LEU . 46.0 mt -54.05 -51.13 65.03 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.228 -0.442 . . . . 74.349999999999994 112.167 177.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 9.3 p -78.68 -43.61 25.63 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 O-C-N 121.94 -0.475 . . . . 63.119999999999997 112.244 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -54.21 -52.63 60.65 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 121.174 0.512 . . . . 70.019999999999996 111.631 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -93.77 5.12 52.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.488 . . . . 72.439999999999998 111.43 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 39.8 mmt180 59.31 38.76 23.01 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.38 -0.373 . . . . 73.310000000000002 111.945 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -27.04 -49.33 0.06 OUTLIER Glycine 0 N--CA 1.471 1.022 0 N-CA-C 116.238 1.255 . . . . 54.350000000000001 116.238 -173.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.423 ' O ' HG23 ' A' ' 147' ' ' VAL . 13.0 m95 -67.45 -51.39 52.04 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 117.733 0.766 . . . . 71.230000000000004 111.716 -178.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -66.82 -29.07 68.9 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 120.905 0.383 . . . . 73.439999999999998 111.11 174.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.546 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -69.43 -37.88 79.58 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.944 -0.463 . . . . 72.409999999999997 111.944 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.408 ' CE1' HG22 ' A' ' 96' ' ' VAL . 19.1 t80 -60.45 -41.4 94.0 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.175 0.512 . . . . 71.329999999999998 110.88 173.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.513 HG21 ' HG3' ' A' ' 39' ' ' LYS . 58.4 t -70.73 -38.21 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 116.033 -0.53 . . . . 74.420000000000002 112.314 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.546 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 12.4 pt-20 -74.0 -40.07 63.2 Favored 'General case' 0 N--CA 1.476 0.841 0 O-C-N 122.274 -0.266 . . . . 71.540000000000006 111.629 178.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -58.24 -48.34 80.71 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 120.978 0.418 . . . . 62.409999999999997 111.463 -178.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -80.75 -9.13 59.83 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.439 -0.346 . . . . 73.010000000000005 111.148 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 67.5 t60 57.93 63.02 1.89 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.458 0.647 . . . . 72.430000000000007 112.19 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.533 HG21 HG23 ' A' ' 43' ' ' THR . 87.4 t -100.33 -69.92 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.979 -0.555 . . . . 63.520000000000003 110.21 177.005 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -100.89 68.16 1.27 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.494 0.664 . . . . 71.109999999999999 109.752 173.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -159.63 166.74 30.04 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.266 -0.879 . . . . 64.439999999999998 111.255 -175.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.574 HD13 ' N ' ' A' ' 155' ' ' LEU . 0.0 OUTLIER -129.77 -10.12 4.44 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 112.673 0.619 . . . . 64.019999999999996 112.673 178.24 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -147.06 -60.22 0.28 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.746 0.307 . . . . 75.040000000000006 111.314 178.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . 0.49 ' HA3' ' HB2' ' A' ' 148' ' ' GLU . . . 48.84 -121.62 8.23 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 115.966 -0.561 . . . . 44.310000000000002 113.752 -178.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 174.89 147.36 6.14 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.281 -0.485 . . . . 63.409999999999997 112.616 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -88.6 -10.62 48.08 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 122.393 -0.475 . . . . 75.129999999999995 111.389 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 53.99 18.92 1.82 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.254 0.835 . . . . 74.209999999999994 113.254 173.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 31.3 m170 -77.81 88.3 4.04 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.296 0.57 . . . . 74.519999999999996 111.906 -177.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 83.2 m-70 -122.37 100.48 6.96 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.578 -0.737 . . . . 52.43 109.848 174.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -159.4 147.65 17.65 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.377 -0.374 . . . . 74.129999999999995 111.055 -174.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 82.7 t60 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.825 -0.607 . . . . 65.319999999999993 110.823 174.851 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 mmt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.207 0.527 . . . . 55.119999999999997 111.223 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -156.35 -170.59 3.41 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 116.07 -0.514 . . . . 71.530000000000001 110.587 -177.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -140.52 177.32 8.09 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 120.675 0.274 . . . . 75.030000000000001 111.547 179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -63.6 -41.0 98.36 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.074 0.398 . . . . 74.120000000000005 112.074 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.525 HD21 ' HB3' ' A' ' 137' ' ' LEU . 63.4 tp -60.26 -41.58 93.54 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.702 0.287 . . . . 74.340000000000003 110.615 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -57.06 -49.04 77.08 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.272 -0.422 . . . . 74.409999999999997 110.82 174.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -63.73 -43.49 96.34 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.884 0.373 . . . . 73.340000000000003 111.714 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.443 ' O ' HG13 ' A' ' 12' ' ' ILE . 54.3 tt0 -62.66 -52.24 64.09 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.159 0.504 . . . . 71.200000000000003 111.308 -179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.1 p -61.61 -44.39 97.08 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.007 -0.542 . . . . 75.340000000000003 111.09 177.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.3 tp -53.61 -45.04 69.92 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 116.232 -0.44 . . . . 54.25 111.44 175.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.21 -51.43 69.02 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 120.715 0.293 . . . . 64.530000000000001 111.571 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 8' ' ' GLN . 62.9 mt -55.8 -51.89 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 CA-C-O 121.117 0.484 . . . . 75.450000000000003 111.386 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.405 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.8 mt -66.72 -49.76 71.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.996 -0.547 . . . . 71.109999999999999 112.195 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 87.9 p -55.5 -47.84 75.56 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.88 0.371 . . . . 75.409999999999997 111.601 -178.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.415 ' NH1' ' HG2' ' A' ' 30' ' ' MET . 44.8 mtp180 -62.55 -41.94 99.22 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 116.406 -0.361 . . . . 73.049999999999997 111.615 178.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.415 ' OH ' ' HA3' ' A' ' 48' ' ' GLY . 56.0 t80 -61.07 -46.49 90.47 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.904 0.383 . . . . 74.319999999999993 111.043 177.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 13' ' ' ILE . 10.1 mp -63.52 -34.56 78.05 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.47 -0.332 . . . . 64.519999999999996 111.601 177.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HE ' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -62.95 -54.06 44.32 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.62 0.248 . . . . 65.439999999999998 111.477 176.552 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 24' ' ' ALA . 42.5 mm-40 -63.0 -35.33 79.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 121.097 0.475 . . . . 74.010000000000005 111.624 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' A' ' 107' ' ' LYS . 71.6 mm-40 -72.37 -28.07 62.78 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.839 0.352 . . . . 73.040000000000006 111.724 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.6 ' HA ' ' HA ' ' A' ' 107' ' ' LYS . . . -72.89 -39.16 66.61 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 121.224 0.535 . . . . 74.200000000000003 110.928 175.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 58.5 p -87.62 -20.12 26.81 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.92 -0.582 . . . . 62.439999999999998 111.849 -178.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.84 40.13 9.79 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 121.654 -0.308 . . . . 31.010000000000002 113.779 175.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' A' ' 19' ' ' GLU . . . -156.11 -163.12 1.4 Allowed 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.351 -0.499 . . . . 62.399999999999999 112.164 -178.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -132.56 147.78 52.36 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.064 -0.516 . . . . 62.030000000000001 110.116 173.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -102.81 -172.84 2.19 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.823 0.821 . . . . 63.530000000000001 112.148 -178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.4 t -150.44 41.6 0.8 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 114.899 -1.046 . . . . 73.340000000000003 109.288 174.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -92.53 141.03 24.19 Favored Pre-proline 0 CA--C 1.541 0.6 0 CA-C-N 115.113 -0.949 . . . . 53.409999999999997 111.908 -175.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.13 143.03 97.34 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 C-N-CA 122.759 2.306 . . . . 71.109999999999999 112.897 175.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.415 ' HG2' ' NH1' ' A' ' 15' ' ' ARG . 64.7 mtp -94.59 179.0 5.41 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 120.942 0.401 . . . . 75.099999999999994 112.036 -178.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -79.65 -136.47 1.41 Allowed Glycine 0 CA--C 1.531 1.045 0 C-N-CA 121.49 -0.386 . . . . 71.430000000000007 114.015 -176.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.44 -42.96 95.7 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 122.39 -0.477 . . . . 73.340000000000003 111.719 -179.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 77.4 p -71.36 133.31 45.89 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.602 -0.272 . . . . 63.240000000000002 111.502 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -112.2 -95.17 2.22 Favored Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.19 -0.529 . . . . 60.350000000000001 113.167 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.1 70.21 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 112.996 0.739 . . . . 65.420000000000002 112.996 -173.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 59.1 m -54.7 -54.18 45.24 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 120.955 0.407 . . . . 73.540000000000006 111.856 -177.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 68.2 m -71.85 -31.48 66.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.461 -0.336 . . . . 72.430000000000007 111.867 -177.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.3 tpt85 -64.02 -48.02 77.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 120.655 0.264 . . . . 65.310000000000002 111.438 178.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.425 ' HG3' HG21 ' A' ' 147' ' ' VAL . 6.1 ptmm? -76.2 -27.78 57.01 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.71 0.291 . . . . 65.200000000000003 111.41 178.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.57 -52.97 48.34 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.837 0.351 . . . . 61.219999999999999 110.948 174.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.5 tp -61.39 -38.27 86.43 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.176 0.512 . . . . 74.340000000000003 110.816 176.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -60.27 -40.52 90.67 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.92 -0.582 . . . . 64.030000000000001 110.827 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.621 HG23 HG21 ' A' ' 152' ' ' VAL . 93.6 m -69.64 -45.54 68.24 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.106 -0.497 . . . . 74.140000000000001 111.202 176.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 47.2 mt -54.28 -46.34 72.68 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.504 0.557 . . . . 72.209999999999994 112.504 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 45' ' ' ARG . 6.5 ptp180 -65.58 -34.11 77.48 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 122.152 -0.342 . . . . 73.120000000000005 111.447 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.1 ttt180 -73.07 -44.84 60.02 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 111.941 0.349 . . . . 74.409999999999997 111.941 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.432 ' O ' HG23 ' A' ' 51' ' ' VAL . 33.5 m -79.72 -34.12 15.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.793 0.33 . . . . 74.129999999999995 111.329 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' OH ' ' A' ' 16' ' ' TYR . . . -66.12 -39.35 94.59 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 121.459 -0.401 . . . . 53.299999999999997 112.859 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.99 -45.63 61.13 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 120.974 0.416 . . . . 72.349999999999994 111.417 174.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -73.44 -51.16 10.09 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 120.985 -0.626 . . . . 61.119999999999997 112.987 177.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.455 ' HA ' HD21 ' A' ' 54' ' ' ASN . 75.5 t -57.44 -53.48 43.53 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 N-CA-C 112.372 0.508 . . . . 50.109999999999999 112.372 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -59.88 -44.81 93.99 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.204 0.446 . . . . 64.349999999999994 112.204 -177.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -65.44 -33.72 76.61 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.098 0.777 . . . . 74.109999999999999 113.098 -175.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.455 HD21 ' HA ' ' A' ' 51' ' ' VAL . 9.9 p30 -84.6 -34.14 23.21 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 121.336 -0.853 . . . . 74.420000000000002 111.062 176.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -75.47 -18.18 59.93 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 112.213 0.449 . . . . 72.310000000000002 112.213 177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -47.86 -55.19 10.37 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 112.644 0.609 . . . . 73.439999999999998 112.644 -174.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 5.8 t -58.93 -35.25 72.79 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.141 0.422 . . . . 62.219999999999999 112.141 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.72 -53.27 23.08 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.828 0.346 . . . . 74.109999999999999 111.649 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -63.92 -33.01 74.74 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.532 -0.303 . . . . 72.319999999999993 111.736 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.53 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 41.4 mm-40 -47.76 -46.79 30.56 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 120.554 0.216 . . . . 63.409999999999997 111.297 176.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.3 -41.07 61.64 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 121.233 -0.508 . . . . 74.109999999999999 112.913 177.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.466 ' O ' ' HG2' ' A' ' 65' ' ' LYS . 85.9 mtp -70.51 -40.88 73.25 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.037 0.446 . . . . 75.310000000000002 111.081 178.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -62.2 -26.89 68.61 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.494 -0.321 . . . . 74.439999999999998 111.799 176.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 60' ' ' GLN . 33.4 mtm180 -60.77 -26.57 67.33 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.233 0.457 . . . . 73.019999999999996 112.233 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 62' ' ' MET . 56.3 pttt -94.71 -8.98 36.19 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.863 0.363 . . . . 52.229999999999997 111.209 176.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.481 HD13 HD21 ' A' ' 77' ' ' LEU . 93.8 mt -105.92 -84.78 0.5 Allowed 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.581 0.585 . . . . 71.219999999999999 112.581 -173.284 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 67.75 -22.41 0.12 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 113.529 0.937 . . . . 72.129999999999995 113.529 -173.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 68' ' ' ILE . 2.4 mp 59.34 95.65 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.659 0.783 . . . . 75.319999999999993 112.456 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.79 -8.65 18.62 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.87 -0.604 . . . . 74.340000000000003 111.443 178.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.448 HD22 ' N ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -161.35 -179.71 7.61 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.377 -0.374 . . . . 71.219999999999999 110.674 175.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 34.8 tt0 -59.74 -37.26 78.47 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 111.837 0.31 . . . . 65.439999999999998 111.837 -178.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -54.28 -36.13 63.32 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 111.863 0.32 . . . . 72.239999999999995 111.863 -174.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -61.75 -44.39 97.0 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.317 0.58 . . . . 73.540000000000006 110.618 175.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.03 -36.97 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 121.265 0.555 . . . . 60.020000000000003 110.828 176.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.6 mmmt -65.13 -31.34 72.49 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.025 0.44 . . . . 71.319999999999993 110.577 176.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 42.7 t -67.78 -40.39 83.97 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.059 0.456 . . . . 74.530000000000001 110.609 173.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.573 ' O ' ' HG2' ' A' ' 81' ' ' MET . 96.7 mt -55.91 -40.3 72.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.133 -0.485 . . . . 71.219999999999999 110.93 175.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.8 t -54.86 -44.5 74.06 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.018 0.437 . . . . 34.329999999999998 111.069 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.0 mmm-85 -57.92 -44.23 86.75 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.147 -0.479 . . . . 74.420000000000002 110.803 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.427 ' O ' HG23 ' A' ' 84' ' ' VAL . 57.6 t -61.08 -41.81 90.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 116.207 -0.452 . . . . 64.0 111.131 176.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.573 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 21.4 mmt -57.7 -43.89 85.47 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.07 0.462 . . . . 62.119999999999997 111.241 179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 68.6 mt -56.13 -41.27 68.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.232 0.539 . . . . 73.230000000000004 110.87 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -74.76 -26.35 59.71 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.447 0.536 . . . . 72.209999999999994 112.447 179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 80' ' ' VAL . 78.8 t -55.91 -33.09 34.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 121.135 0.493 . . . . 74.540000000000006 111.178 174.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.493 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 59.3 m-85 -81.98 14.95 2.49 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.485 0.55 . . . . 60.030000000000001 112.485 179.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.8 t -58.8 -37.03 75.46 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.931 0.396 . . . . 72.430000000000007 110.975 176.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.02 85.37 0.09 Allowed 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.426 0.632 . . . . 72.239999999999995 112.08 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.65 54.59 4.64 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 116.05 -0.523 . . . . 72.030000000000001 112.11 174.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.0 m -114.57 165.8 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-O 120.853 0.359 . . . . 74.239999999999995 111.479 -176.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.1 m -78.82 69.25 4.96 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.366 0.603 . . . . 61.299999999999997 111.141 178.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -148.04 158.87 44.3 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.931 -0.577 . . . . 53.0 111.409 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.404 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.1 m95 -106.11 -5.18 19.59 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.198 -0.455 . . . . 71.420000000000002 111.413 176.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -53.46 -35.79 51.96 Favored Glycine 0 CA--C 1.531 1.082 0 C-N-CA 121.428 -0.415 . . . . 63.100000000000001 113.225 177.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -54.82 -40.41 69.53 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 111.998 0.37 . . . . 72.239999999999995 111.998 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.401 HG13 ' HE3' ' A' ' 92' ' ' TRP . 44.8 mm -66.64 -46.47 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.525 0 CA-C-O 120.905 0.383 . . . . 52.299999999999997 110.839 177.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 43.7 t -57.93 -43.33 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 120.978 0.418 . . . . 74.140000000000001 110.838 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.1 m -59.82 -42.25 93.09 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.168 -0.469 . . . . 63.210000000000001 111.239 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.528 HD12 ' SD ' ' A' ' 81' ' ' MET . 29.1 tp -59.54 -54.67 43.82 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.258 0.552 . . . . 53.32 111.67 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 59.4 mt -69.7 -39.99 78.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 115.991 -0.549 . . . . 73.409999999999997 111.873 -176.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.2 p -63.45 -45.76 89.38 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 116.593 -0.276 . . . . 72.329999999999998 111.743 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.66 -43.27 93.99 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.795 0.331 . . . . 72.140000000000001 111.018 176.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.43 -45.47 92.93 Favored Glycine 0 CA--C 1.529 0.906 0 C-N-CA 120.904 -0.665 . . . . 61.399999999999999 112.314 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.34 -35.32 80.63 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.113 0.482 . . . . 73.230000000000004 111.647 177.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -64.75 -40.82 95.93 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.151 -0.477 . . . . 73.140000000000001 111.242 178.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 59.9 t -71.9 -38.44 64.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 120.838 0.352 . . . . 72.120000000000005 110.673 176.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.43 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.68 0.622 . . . . 73.129999999999995 112.68 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -61.27 -38.89 88.38 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 120.849 0.357 . . . . 71.510000000000005 111.494 178.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.437 ' O ' HG12 ' A' ' 112' ' ' ILE . 83.4 t60 -65.59 -36.71 84.54 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 120.746 0.308 . . . . 74.349999999999994 110.703 175.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 105' ' ' VAL . 81.4 mt -62.95 -50.44 70.8 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.489 -0.323 . . . . 42.219999999999999 111.859 178.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -61.87 -40.01 93.89 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.836 0.35 . . . . 51.030000000000001 111.075 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 95.2 m -57.48 -37.82 73.53 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.403 -0.362 . . . . 53.420000000000002 111.737 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.6 pt -97.56 21.66 1.28 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.73 0 CA-C-O 120.913 0.387 . . . . 70.239999999999995 111.646 177.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 68.75 6.81 5.75 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.637 0.977 . . . . 72.010000000000005 113.637 174.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -82.87 40.92 0.71 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 112.281 0.474 . . . . 63.119999999999997 112.281 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.0 -33.01 72.58 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 121.859 -0.526 . . . . 74.310000000000002 111.27 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 38.8 m -56.74 -28.09 60.51 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 116.519 -0.31 . . . . 73.310000000000002 111.435 175.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 39.9 m -79.24 -27.04 42.4 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 120.769 0.318 . . . . 74.430000000000007 111.834 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 66.5 mt -59.73 -41.39 85.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.735 0 N-CA-C 112.482 0.549 . . . . 74.319999999999993 112.482 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -62.2 -56.42 31.26 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 112.402 0.519 . . . . 65.319999999999993 112.402 -178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.19 -30.23 90.82 Favored 'Trans proline' 0 C--N 1.362 1.247 0 C-N-CA 121.846 1.697 . . . . 62.329999999999998 112.419 176.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.9 tt -64.14 -50.18 69.22 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 109.66 -0.496 . . . . 61.420000000000002 109.66 174.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.75 -41.54 77.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.008 -0.542 . . . . 74.340000000000003 111.381 177.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -61.91 -46.19 90.46 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.448 -0.342 . . . . 71.310000000000002 111.009 175.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 63.9 m -56.4 -38.34 71.39 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.206 0.447 . . . . 44.049999999999997 112.206 -178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.408 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.4 mm -57.2 -53.88 37.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-O 121.204 0.526 . . . . 72.409999999999997 111.014 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 38.3 m -71.41 -33.76 69.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.935 -0.575 . . . . 71.540000000000006 111.453 179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -59.82 -51.58 69.14 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 116.165 -0.471 . . . . 73.450000000000003 111.163 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.614 ' O ' HG22 ' A' ' 132' ' ' THR . 63.1 t -64.29 -48.89 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-O 120.87 0.367 . . . . 64.450000000000003 110.633 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.59 ' HG ' HD11 ' A' ' 137' ' ' LEU . 59.8 tp -49.21 -52.65 25.58 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.878 -0.601 . . . . 73.340000000000003 111.817 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.589 HG13 ' HD3' ' A' ' 134' ' ' ARG . 54.0 t -66.28 -52.24 49.69 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 116.231 -0.441 . . . . 55.009999999999998 111.519 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 131' ' ' ARG . 42.3 ttm105 -48.18 -46.08 34.42 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.89 0.7 . . . . 71.129999999999995 112.89 -176.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.614 HG22 ' O ' ' A' ' 128' ' ' VAL . 3.8 t -99.93 -28.76 12.93 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 114.082 1.141 . . . . 73.010000000000005 114.082 -173.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.57 ' HD2' HG23 ' A' ' 132' ' ' THR . 1.4 mptp? -131.82 31.05 4.27 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.529 0.937 . . . . 75.040000000000006 113.529 -178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.589 ' HD3' HG13 ' A' ' 130' ' ' VAL . 37.3 tpt85 -54.5 -45.96 73.37 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.018 0.437 . . . . 73.430000000000007 111.754 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -59.11 -50.85 72.47 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.049 -0.523 . . . . 62.350000000000001 111.703 178.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -57.79 -37.09 73.1 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 111.956 0.354 . . . . 74.209999999999994 111.956 -178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.59 HD11 ' HG ' ' A' ' 129' ' ' LEU . 77.6 mt -57.16 -48.56 78.4 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 112.11 0.411 . . . . 74.319999999999993 112.11 177.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 11.9 p -77.19 -36.83 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 O-C-N 122.156 -0.34 . . . . 61.310000000000002 111.753 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.45 -53.36 59.06 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.009 0.433 . . . . 75.099999999999994 111.865 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -93.89 7.01 46.59 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.118 0.414 . . . . 73.209999999999994 112.118 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 52.97 54.51 10.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.017 0.437 . . . . 72.530000000000001 110.509 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.404 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . -30.94 -56.69 0.27 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 115.964 1.146 . . . . 71.209999999999994 115.964 -170.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.506 ' O ' HG23 ' A' ' 147' ' ' VAL . 18.6 m95 -69.87 -44.19 70.31 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 117.388 0.594 . . . . 74.510000000000005 112.548 -173.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -64.65 -51.2 63.81 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.927 0.394 . . . . 74.430000000000007 111.14 174.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' A' ' 148' ' ' GLU . . . -57.14 -38.37 85.52 Favored Glycine 0 CA--C 1.523 0.543 0 CA-C-N 116.059 -0.519 . . . . 61.140000000000001 112.803 178.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -57.83 -53.79 54.28 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.037 0.446 . . . . 64.230000000000004 111.527 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 143' ' ' TRP . 29.8 t -66.02 -42.5 91.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 N-CA-C 112.135 0.42 . . . . 72.439999999999998 112.135 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.427 ' HG2' ' HA2' ' A' ' 145' ' ' GLY . 11.3 pt-20 -70.43 -34.15 72.15 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 122.168 -0.332 . . . . 63.200000000000003 111.544 179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -62.2 -47.48 84.25 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.994 0.426 . . . . 73.340000000000003 110.816 178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -79.78 -4.63 52.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.304 -0.407 . . . . 74.239999999999995 111.391 174.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 32.7 p80 43.02 39.75 1.94 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.109 0.963 . . . . 71.219999999999999 112.964 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.621 HG21 HG23 ' A' ' 43' ' ' THR . 56.1 t -65.05 -65.42 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 116.581 -0.281 . . . . 75.540000000000006 111.39 178.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -98.42 4.77 48.46 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.771 0.319 . . . . 72.530000000000001 111.342 178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -135.11 175.99 9.08 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.451 0.644 . . . . 70.239999999999995 111.917 -174.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.506 ' H ' HD13 ' A' ' 155' ' ' LEU . 0.0 OUTLIER -138.43 9.0 2.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.399 -0.819 . . . . 74.040000000000006 109.967 171.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -93.88 21.63 6.42 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 115.393 -0.821 . . . . 74.120000000000005 112.271 -172.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -151.67 -168.96 16.67 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.963 -0.637 . . . . 73.5 113.194 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 85.47 -79.91 1.85 Allowed Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.036 -0.602 . . . . 73.299999999999997 112.729 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -83.22 85.46 7.2 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.386 0.612 . . . . 70.040000000000006 110.169 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -131.72 134.31 45.76 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.675 -0.693 . . . . 75.230000000000004 111.375 -173.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -69.83 125.07 25.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 109.792 -0.448 . . . . 72.109999999999999 109.792 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -54.35 -53.65 51.07 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.652 0.612 . . . . 73.420000000000002 112.652 -172.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -86.88 93.57 9.34 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.961 0.41 . . . . 74.530000000000001 111.467 178.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.759 -0.639 . . . . 64.409999999999997 111.125 176.682 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.0 tpp . . . . . 0 N--CA 1.493 1.718 0 CA-C-O 121.16 0.505 . . . . 72.209999999999994 111.321 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.459 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 0.1 OUTLIER -72.98 177.48 4.92 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 112.913 0.708 . . . . 72.299999999999997 112.913 -177.711 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -105.03 164.9 11.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.562 -0.744 . . . . 73.209999999999994 111.025 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.53 -46.18 77.1 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-O 121.016 0.436 . . . . 73.049999999999997 111.26 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.7 tp -58.55 -34.11 70.67 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.109 -0.496 . . . . 63.140000000000001 110.773 177.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.444 ' CG ' ' HB2' ' A' ' 2' ' ' GLU . 11.1 t80 -67.23 -43.4 82.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.963 -0.562 . . . . 62.32 110.536 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 7' ' ' ARG . 7.7 mmt180 -67.85 -43.63 79.01 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.189 0.44 . . . . 74.319999999999993 112.189 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -58.0 -50.85 71.99 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.208 0.528 . . . . 64.349999999999994 110.693 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.3 p -64.04 -51.89 62.02 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.907 -0.588 . . . . 63.25 111.544 178.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 61.7 tp -51.98 -42.73 63.16 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 111.857 0.317 . . . . 74.430000000000007 111.857 177.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -57.78 -52.83 63.87 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.124 0.488 . . . . 74.329999999999998 111.044 177.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.4 mt -62.51 -48.38 88.53 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-N 115.851 -0.613 . . . . 71.439999999999998 111.897 -179.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 99' ' ' ILE . 75.3 mt -64.09 -52.52 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-N 116.359 -0.382 . . . . 65.340000000000003 111.968 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 96.7 p -52.78 -47.72 67.33 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 120.807 0.337 . . . . 73.010000000000005 111.637 -178.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 19' ' ' GLU . 74.6 mtt180 -57.52 -51.26 70.17 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.648 -0.251 . . . . 63.130000000000003 110.8 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -53.22 -39.27 63.63 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.02 0.378 . . . . 72.430000000000007 112.02 -177.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.56 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.9 mp -62.93 -46.14 89.17 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 111.57 0.211 . . . . 73.109999999999999 111.57 176.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -64.67 -34.69 78.88 Favored 'General case' 0 N--CA 1.474 0.772 0 O-C-N 122.118 -0.364 . . . . 70.310000000000002 111.356 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 20.0 mm-40 -56.63 -51.76 67.47 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.306 0.574 . . . . 73.310000000000002 111.114 176.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.4 ' HB3' ' HE2' ' A' ' 107' ' ' LYS . 27.8 mm-40 -77.97 -23.42 48.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.962 -0.563 . . . . 70.349999999999994 112.495 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.01 -48.27 21.66 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.978 0.418 . . . . 64.209999999999994 111.59 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.445 HG22 ' HE3' ' A' ' 110' ' ' LYS . 32.8 p -92.07 -38.77 12.01 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.095 0.405 . . . . 60.0 112.095 -177.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.88 16.4 63.44 Favored Glycine 0 CA--C 1.527 0.842 0 C-N-CA 121.217 -0.516 . . . . 65.150000000000006 112.696 -175.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.43 114.54 15.68 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 122.7 -0.294 . . . . 51.409999999999997 111.373 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -67.33 151.88 46.69 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.674 0.62 . . . . 72.209999999999994 112.674 -176.564 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -99.86 -168.78 1.65 Allowed 'General case' 0 CA--C 1.544 0.738 0 CA-C-O 121.003 0.43 . . . . 74.140000000000001 111.06 175.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -152.28 29.13 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.208 0.528 . . . . 35.539999999999999 111.565 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -76.04 150.52 83.42 Favored Pre-proline 0 CA--C 1.541 0.625 0 CA-C-O 120.958 0.409 . . . . 61.130000000000003 111.76 -178.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.46 130.0 33.68 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 122.701 2.267 . . . . 63.130000000000003 112.765 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 20.8 mmt -69.92 158.44 35.57 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.736 0.303 . . . . 73.120000000000005 111.677 176.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.42 -81.26 0.08 OUTLIER Glycine 0 CA--C 1.531 1.047 0 C-N-CA 121.136 -0.555 . . . . 34.149999999999999 112.927 176.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -137.23 159.16 42.71 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.515 -0.403 . . . . 34.200000000000003 111.375 176.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 67.4 m 63.55 88.19 0.1 Allowed 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.379 0.672 . . . . 74.0 111.398 -174.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.9 -58.84 8.95 Favored Glycine 0 CA--C 1.524 0.604 0 CA-C-N 115.808 -0.633 . . . . 35.240000000000002 113.122 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.77 -50.11 71.33 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 111.837 0.31 . . . . 53.100000000000001 111.837 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 95.6 m -61.68 -53.25 58.59 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 112.015 0.376 . . . . 54.240000000000002 112.015 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.2 m -60.83 -33.06 72.46 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.842 0.353 . . . . 64.5 111.635 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 71.1 ttt-85 -68.03 -56.53 8.57 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 120.841 0.353 . . . . 73.439999999999998 111.408 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 16.9 ptmt -64.41 -32.05 73.52 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.403 -0.362 . . . . 72.030000000000001 111.518 -177.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -47.5 78.9 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 120.842 0.354 . . . . 70.430000000000007 111.089 175.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.504 ' HG ' HH21 ' A' ' 45' ' ' ARG . 51.7 tp -64.67 -38.0 89.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.286 0.476 . . . . 73.019999999999996 112.286 -178.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 12.1 pt-20 -75.79 -34.67 60.2 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 122.002 -0.436 . . . . 73.030000000000001 111.415 178.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.536 ' OG1' HG21 ' A' ' 152' ' ' VAL . 56.8 m -67.47 -38.67 84.75 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.083 -0.386 . . . . 53.509999999999998 111.138 176.121 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.64 -43.87 69.12 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 111.925 0.342 . . . . 74.409999999999997 111.925 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.504 HH21 ' HG ' ' A' ' 41' ' ' LEU . 16.0 ptp180 -78.72 -36.65 43.01 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.828 0.346 . . . . 74.219999999999999 111.176 177.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.483 ' NH1' HG13 ' A' ' 152' ' ' VAL . 32.4 ttt180 -57.12 -43.13 82.03 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.169 0.587 . . . . 74.420000000000002 112.163 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 43' ' ' THR . 19.3 m -101.59 -33.96 3.68 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 120.855 0.36 . . . . 63.520000000000003 111.642 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.454 ' O ' ' HG3' ' A' ' 52' ' ' GLN . . . -61.96 -35.9 92.07 Favored Glycine 0 C--N 1.333 0.375 0 CA-C-N 116.317 -0.401 . . . . 75.109999999999999 113.614 -177.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 28.4 t70 -54.68 -55.49 29.13 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.064 0.459 . . . . 75.299999999999997 110.981 178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.05 99.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 121.13 -0.557 . . . . 53.409999999999997 112.752 176.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 47' ' ' VAL . 65.6 t -57.28 -46.98 85.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 O-C-N 122.659 -0.318 . . . . 70.219999999999999 111.504 178.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 48' ' ' GLY . 77.9 mt-30 -55.86 -46.66 78.18 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.655 0.264 . . . . 44.149999999999999 111.158 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 35.3 mtp85 -60.92 -41.12 95.55 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.179 0.437 . . . . 63.109999999999999 112.179 -177.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -71.48 -37.57 71.29 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-O 121.242 0.544 . . . . 74.019999999999996 111.496 177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -83.83 -19.05 35.62 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.646 0.61 . . . . 64.310000000000002 112.646 -177.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 60' ' ' GLN . 38.9 tt0 -49.17 -55.3 12.85 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.298 0.481 . . . . 64.319999999999993 112.298 -174.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -52.17 -34.78 46.5 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.904 0.383 . . . . 61.340000000000003 112.0 178.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -74.47 -42.39 59.12 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.87 0.367 . . . . 72.430000000000007 111.719 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -69.87 -34.36 73.48 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.12 0.415 . . . . 73.319999999999993 112.12 -178.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 84.0 mm-40 -51.04 -38.24 50.24 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.084 0.469 . . . . 71.140000000000001 111.322 176.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.508 ' HA2' HH11 ' A' ' 64' ' ' ARG . . . -58.67 -33.0 70.62 Favored Glycine 0 CA--C 1.528 0.894 0 CA-C-N 116.01 -0.541 . . . . 75.420000000000002 113.861 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.486 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 71.0 mtm -90.05 -45.31 9.24 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 122.293 -0.533 . . . . 75.319999999999993 111.717 178.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.22 -29.52 61.11 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.517 0.562 . . . . 65.019999999999996 112.517 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.508 HH11 ' HA2' ' A' ' 61' ' ' GLY . 18.3 ptt-85 -65.24 -19.0 65.76 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 120.748 0.309 . . . . 63.119999999999997 111.737 179.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.0 3.46 8.69 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 112.881 0.697 . . . . 64.25 112.881 -178.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 62' ' ' MET . 82.5 mt -90.25 -77.32 0.4 Allowed 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 111.904 0.335 . . . . 73.019999999999996 111.904 178.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 52.52 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.654 0.74 . . . . 73.430000000000007 112.49 -174.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.53 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -77.86 99.12 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 115.62 -0.718 . . . . 62.439999999999998 110.532 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.46 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -105.86 -9.87 16.95 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.961 -0.563 . . . . 72.549999999999997 112.194 -176.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.46 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -157.46 173.75 16.43 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 120.845 0.355 . . . . 61.5 111.431 173.266 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -56.53 -39.67 73.77 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.16 0.8 . . . . 62.299999999999997 113.16 -171.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -54.34 -34.46 61.1 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 120.739 0.304 . . . . 52.030000000000001 111.344 -177.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.53 ' HB2' HG23 ' A' ' 68' ' ' ILE . 49.3 m-20 -63.39 -46.25 87.31 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.025 0.441 . . . . 60.109999999999999 110.849 176.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 80.3 t -58.28 -46.07 89.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 CA-C-O 121.378 0.608 . . . . 73.219999999999999 110.512 176.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 75' ' ' LYS . 6.6 mtpm? -64.16 -28.0 69.46 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.765 -0.652 . . . . 75.5 110.915 177.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 55.4 m -73.03 -36.36 66.95 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.897 0.379 . . . . 42.299999999999997 110.789 174.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 81' ' ' MET . 87.1 mt -61.72 -37.09 82.91 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.482 -0.326 . . . . 72.420000000000002 110.896 175.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.1 t -52.78 -39.52 62.35 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.188 0.518 . . . . 71.530000000000001 111.135 176.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 -62.6 -38.78 91.53 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.926 -0.579 . . . . 72.420000000000002 110.896 177.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.71 -42.89 93.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 120.876 0.369 . . . . 73.329999999999998 110.74 175.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 20.7 mmt -54.96 -40.98 70.58 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.017 -0.538 . . . . 74.340000000000003 111.256 178.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 78.6 mt -61.2 -43.05 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.091 -0.504 . . . . 72.109999999999999 111.013 175.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -67.06 -28.77 68.47 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.087 -0.506 . . . . 70.030000000000001 112.064 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 91.8 t -55.46 -35.05 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 CA-C-O 121.112 0.482 . . . . 55.420000000000002 111.366 177.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.532 ' HA ' ' NH2' ' A' ' 94' ' ' ARG . 73.8 m-85 -95.54 29.22 2.66 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.128 0.418 . . . . 64.299999999999997 112.128 -179.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 67.0 p -74.59 -43.84 53.64 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 112.271 0.471 . . . . 61.109999999999999 112.271 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -69.32 157.41 37.07 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.069 0.461 . . . . 71.329999999999998 111.812 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.38 66.38 0.3 Allowed Glycine 0 CA--C 1.527 0.815 0 N-CA-C 114.477 0.551 . . . . 43.109999999999999 114.477 -172.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.418 HG13 ' HD2' ' A' ' 94' ' ' ARG . 10.8 p -135.38 143.99 35.34 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 O-C-N 122.453 -0.439 . . . . 54.409999999999997 111.01 173.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.9 t -94.63 28.5 2.62 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 113.088 0.773 . . . . 73.310000000000002 113.088 -172.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 75.1 m-20 -72.81 123.81 24.12 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.987 -0.445 . . . . 61.210000000000001 111.436 178.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.459 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 94.0 m95 -61.86 -17.81 57.82 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 111.875 0.324 . . . . 73.319999999999993 111.875 177.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.74 -24.59 49.12 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 121.276 -0.488 . . . . 73.0 112.999 174.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.532 ' NH2' ' HA ' ' A' ' 85' ' ' PHE . 73.1 mtp180 -66.65 -43.04 85.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.938 0.399 . . . . 74.150000000000006 110.452 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 41.6 mm -60.72 -43.44 95.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-O 121.217 0.532 . . . . 74.25 110.297 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 32.1 t -60.54 -42.71 92.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.929 -0.578 . . . . 54.32 110.959 176.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.9 m -60.87 -42.56 98.13 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.93 0.395 . . . . 63.340000000000003 111.162 176.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.491 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 27.0 tp -59.66 -54.64 44.1 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.263 0.554 . . . . 73.349999999999994 111.515 177.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.463 HG23 HG23 ' A' ' 13' ' ' ILE . 59.4 mt -69.1 -37.84 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 CA-C-N 116.073 -0.512 . . . . 72.049999999999997 111.746 -177.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 96.5 p -65.6 -40.37 92.6 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.33 -0.231 . . . . 55.32 111.311 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 29.2 t80 -62.22 -42.3 99.18 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.666 0.27 . . . . 65.340000000000003 110.506 174.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.76 -47.2 87.44 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 120.914 -0.66 . . . . 44.549999999999997 112.219 174.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 107' ' ' LYS . . . -66.42 -34.65 78.42 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.946 0.403 . . . . 50.219999999999999 111.582 177.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -64.87 -45.51 85.7 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.044 0.449 . . . . 73.540000000000006 110.679 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 80.0 t -66.75 -37.49 79.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 116.335 -0.393 . . . . 63.310000000000002 110.584 175.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.74 -40.85 66.49 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.212 -0.449 . . . . 74.129999999999995 111.793 177.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 93.7 mttt -57.28 -49.36 76.34 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.111 0.482 . . . . 75.200000000000003 110.651 176.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.438 ' O ' HG12 ' A' ' 112' ' ' ILE . 84.5 t60 -64.68 -33.2 75.39 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.103 -0.499 . . . . 72.430000000000007 110.996 178.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.508 HD21 ' HB ' ' A' ' 68' ' ' ILE . 76.6 mt -62.95 -50.78 69.47 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.619 -0.264 . . . . 73.340000000000003 111.44 177.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.445 ' HE3' HG22 ' A' ' 22' ' ' THR . 61.6 tttm -65.39 -27.41 68.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.984 0.421 . . . . 70.409999999999997 110.609 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 90.1 m -65.66 -31.67 72.82 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 111.382 175.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 108' ' ' HIS . 32.8 pt -108.77 36.34 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-O 120.777 0.322 . . . . 73.299999999999997 111.455 177.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.1 p30 47.7 20.41 0.2 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.225 1.194 . . . . 51.399999999999999 114.225 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -89.17 35.71 0.81 Allowed 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.203 0.525 . . . . 74.530000000000001 110.879 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -56.69 -39.24 73.47 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 116.008 -0.542 . . . . 73.340000000000003 112.105 -177.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 79.1 p -65.37 -27.63 68.7 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 116.491 -0.322 . . . . 55.25 111.643 178.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.5 m -68.57 -26.4 65.38 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.545 0.338 . . . . 74.099999999999994 111.81 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 68.9 mt -55.23 -40.78 57.58 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 N-CA-C 112.62 0.6 . . . . 60.32 112.62 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.95 -52.52 23.87 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 112.852 0.686 . . . . 51.420000000000002 112.852 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.14 -27.14 84.27 Favored 'Trans proline' 0 C--N 1.358 1.066 0 C-N-CA 121.88 1.72 . . . . 64.450000000000003 112.159 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.3 tt -64.65 -46.36 82.86 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 109.831 -0.433 . . . . 64.409999999999997 109.831 172.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.56 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.07 -39.4 78.43 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.02 0.438 . . . . 61.149999999999999 111.132 174.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.62 -43.17 97.8 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.405 -0.361 . . . . 64.0 110.943 175.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 52.2 m -58.71 -47.47 84.44 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.886 0.374 . . . . 72.340000000000003 111.015 177.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 44.8 mm -52.7 -52.51 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.44 0.638 . . . . 63.409999999999997 111.087 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 28.8 m -67.04 -38.41 85.83 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.421 -0.809 . . . . 70.349999999999994 112.261 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.406 ' HA ' ' HE2' ' A' ' 6' ' ' TYR . 30.1 t70 -64.07 -51.15 65.45 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.674 0.273 . . . . 65.329999999999998 110.889 -178.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 67.0 t -60.4 -33.85 55.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.371 0.605 . . . . 65.420000000000002 110.944 175.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.546 ' HG ' HD11 ' A' ' 137' ' ' LEU . 38.8 tp -66.12 -54.04 30.52 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.999 -0.546 . . . . 74.530000000000001 111.917 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.447 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 61.5 t -76.49 -29.63 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 N-CA-C 111.941 0.349 . . . . 65.200000000000003 111.941 -176.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -53.56 -49.94 66.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.989 0.423 . . . . 63.210000000000001 112.122 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.532 ' OG1' ' HD3' ' A' ' 133' ' ' LYS . 10.5 p -109.99 -39.23 5.11 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.402 0.519 . . . . 75.319999999999993 112.402 -175.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.532 ' HD3' ' OG1' ' A' ' 132' ' ' THR . 2.7 mppt? -82.46 10.79 6.51 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.294 0.479 . . . . 72.340000000000003 112.294 -177.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 20.9 tpt180 -45.71 -61.24 1.79 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.849 0.685 . . . . 64.329999999999998 112.849 -178.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.05 -49.06 79.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.071 0.462 . . . . 64.340000000000003 111.363 -178.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 58.6 m95 -60.68 -36.93 79.97 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.156 -0.475 . . . . 72.409999999999997 111.996 -177.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.546 HD11 ' HG ' ' A' ' 129' ' ' LEU . 29.7 mt -59.35 -54.48 46.26 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.685 0.254 . . . . 73.219999999999999 111.685 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.8 p -71.11 -38.44 71.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 N-CA-C 112.027 0.38 . . . . 54.149999999999999 112.027 -178.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -63.12 -46.02 89.27 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 112.122 0.416 . . . . 72.120000000000005 112.122 178.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -94.65 6.23 49.48 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 120.995 0.426 . . . . 73.430000000000007 111.317 -178.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . . . . . . . . . 77.3 mtt180 62.05 26.63 16.06 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.92 -0.582 . . . . 63.450000000000003 112.281 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.459 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 25.83 -83.09 0.0 OUTLIER Glycine 0 N--CA 1.468 0.787 0 N-CA-C 115.903 1.121 . . . . 73.319999999999993 115.903 173.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.402 ' O ' HG23 ' A' ' 147' ' ' VAL . 12.5 m95 -75.34 -38.17 60.31 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.124 0.416 . . . . 62.020000000000003 112.124 -173.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 148' ' ' GLU . 20.0 m-20 -64.69 -48.08 76.01 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.922 -0.399 . . . . 75.530000000000001 109.922 173.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -62.3 -36.53 93.19 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 121.148 -0.549 . . . . 64.439999999999998 112.492 177.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.05 -49.34 74.02 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 122.921 0.488 . . . . 71.430000000000007 111.164 174.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.512 HG21 ' HG3' ' A' ' 39' ' ' LYS . 57.5 t -68.89 -35.96 71.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 116.351 -0.386 . . . . 61.219999999999999 111.281 178.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 144' ' ' ASP . 46.0 mt-10 -57.5 -47.54 81.65 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.088 0.47 . . . . 54.439999999999998 111.154 176.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -60.04 -48.96 79.53 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.077 -0.511 . . . . 75.439999999999998 111.728 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -83.94 -3.63 58.1 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.157 0.428 . . . . 74.219999999999999 112.157 178.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 154' ' ' ASP . 32.4 p80 44.59 86.49 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 113.92 1.082 . . . . 72.140000000000001 113.92 175.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.536 HG21 ' OG1' ' A' ' 43' ' ' THR . 81.8 t -98.67 -50.26 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 121.219 0.533 . . . . 74.109999999999999 110.691 176.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -105.19 -15.23 15.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 121.837 0.827 . . . . 75.230000000000004 109.572 170.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 151' ' ' HIS . 0.5 OUTLIER -86.12 70.28 10.56 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 114.879 -1.055 . . . . 71.540000000000006 110.851 -174.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -23.82 6.37 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.454 0.909 . . . . 44.32 113.454 -174.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -74.76 -5.79 45.3 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.861 0.689 . . . . 72.209999999999994 112.861 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . . . . . . . . . . . -76.1 42.32 1.62 Allowed Glycine 0 CA--C 1.533 1.17 0 C-N-CA 121.32 -0.467 . . . . 73.040000000000006 114.265 -177.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -86.09 104.24 2.86 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 121.3 -0.476 . . . . 62.140000000000001 111.922 176.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 18.2 p80 -115.4 99.4 7.35 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 112.638 0.607 . . . . 63.240000000000002 112.638 -174.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -91.13 -26.48 19.09 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.982 0.42 . . . . 71.120000000000005 110.575 174.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -63.38 113.91 3.53 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 115.987 -0.552 . . . . 75.510000000000005 111.51 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -92.44 108.73 20.19 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.213 -0.449 . . . . 75.540000000000006 111.982 -176.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 34.3 p80 -61.55 176.65 0.47 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 116.538 -0.301 . . . . 74.420000000000002 110.836 172.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 48.9 t60 . . . . . 0 C--O 1.252 1.234 0 CA-C-O 118.331 -0.842 . . . . 74.409999999999997 110.783 176.389 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mmt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 120.98 0.419 . . . . 72.129999999999995 110.625 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.9 mp0 -106.63 143.14 35.16 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.969 0.414 . . . . 75.109999999999999 111.305 -175.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -72.08 162.93 28.75 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.194 0.813 . . . . 62.210000000000001 113.194 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -49.82 -47.57 51.33 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.334 -0.848 . . . . 74.310000000000002 111.61 175.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.456 HD21 ' HB2' ' A' ' 137' ' ' LEU . 66.3 tp -69.54 -36.54 76.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 115.815 -0.63 . . . . 74.340000000000003 111.413 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -68.12 -44.56 75.85 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.236 -0.438 . . . . 73.219999999999999 111.297 -177.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.608 ' O ' ' HB2' ' A' ' 11' ' ' GLU . 24.8 mmm180 -71.94 -32.77 67.66 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.224 0.453 . . . . 63.32 112.224 179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.501 ' NE2' ' HB2' ' A' ' 33' ' ' SER . 6.7 tp60 -64.16 -51.85 61.83 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.146 0.498 . . . . 73.450000000000003 111.07 174.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.1 p -61.68 -54.51 41.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.093 -0.503 . . . . 73.409999999999997 111.673 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.519 HD23 HH11 ' A' ' 7' ' ' ARG . 50.6 tp -54.35 -37.96 65.52 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.444 -0.344 . . . . 64.420000000000002 111.832 178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.608 ' HB2' ' O ' ' A' ' 7' ' ' ARG . 1.9 tm-20 -60.28 -53.43 57.79 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.263 0.554 . . . . 73.209999999999994 111.273 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.449 HD13 ' HB3' ' A' ' 40' ' ' ALA . 65.0 mt -63.5 -47.76 90.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 115.811 -0.631 . . . . 75.519999999999996 111.342 -178.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 74.6 mt -61.64 -51.42 72.94 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-N 116.04 -0.527 . . . . 75.5 111.623 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.2 t -52.13 -50.05 62.47 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 121.05 0.452 . . . . 52.32 111.733 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.924 HH12 ' HB2' ' A' ' 28' ' ' LYS . 66.7 mtt-85 -62.78 -42.02 99.51 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 120.859 -0.337 . . . . 70.230000000000004 111.657 179.196 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -57.6 -44.08 85.16 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.897 0.38 . . . . 73.549999999999997 111.613 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 122' ' ' ALA . 10.2 mp -56.84 -44.38 82.04 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 120.965 0.412 . . . . 72.219999999999999 110.571 174.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.3 mmt85 -66.52 -32.72 74.25 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 116.319 -0.4 . . . . 74.120000000000005 111.996 175.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 8.6 mm-40 -62.35 -41.99 99.04 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.354 0.597 . . . . 74.230000000000004 110.645 177.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -78.46 -30.67 47.53 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.636 -0.711 . . . . 73.5 112.207 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.32 -38.69 71.7 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.937 0.398 . . . . 74.430000000000007 111.739 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 63.6 p -87.05 -36.21 18.31 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.766 0.317 . . . . 64.310000000000002 111.715 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.63 19.74 65.37 Favored Glycine 0 CA--C 1.524 0.638 0 C-N-CA 121.06 -0.591 . . . . 71.140000000000001 111.966 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -124.16 -163.89 1.19 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.562 0.345 . . . . 64.040000000000006 111.293 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.458 ' HD2' ' O ' ' A' ' 26' ' ' ASP . 0.0 OUTLIER -120.65 151.52 39.38 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 120.962 0.411 . . . . 61.509999999999998 111.372 175.755 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' HD2' ' A' ' 25' ' ' LYS . 29.5 t70 -67.27 154.38 41.44 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 121.45 0.643 . . . . 75.099999999999994 112.601 -177.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.5 t -140.05 25.83 2.27 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.97 -0.559 . . . . 65.019999999999996 111.803 -176.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.924 ' HB2' HH12 ' A' ' 15' ' ' ARG . 21.5 mtpp -128.52 164.14 40.06 Favored Pre-proline 0 CA--C 1.545 0.782 0 O-C-N 122.116 -0.365 . . . . 53.520000000000003 111.697 -173.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.478 ' HD2' ' HB3' ' A' ' 28' ' ' LYS . 29.8 Cg_endo -63.88 112.44 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.862 0 C-N-CA 122.456 2.104 . . . . 71.420000000000002 112.613 178.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.563 ' HE1' HD22 ' A' ' 41' ' ' LEU . 57.1 mtp -83.74 -166.9 1.52 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.433 0.901 . . . . 53.109999999999999 113.433 -172.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.579 ' HA2' ' HG3' ' A' ' 11' ' ' GLU . . . -38.07 145.42 0.16 Allowed Glycine 0 C--N 1.341 0.814 0 N-CA-C 116.114 1.206 . . . . 64.150000000000006 116.114 -178.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -54.2 -25.36 22.38 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.154 0.982 . . . . 74.319999999999993 113.619 -178.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.501 ' HB2' ' NE2' ' A' ' 8' ' ' GLN . 26.6 m -78.83 0.0 28.83 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 112.457 0.54 . . . . 75.540000000000006 112.457 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 68.48 -119.58 10.41 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 121.324 -0.465 . . . . 73.209999999999994 113.953 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' LYS . . . -51.09 -42.55 60.68 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.62 0.6 . . . . 74.140000000000001 112.62 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 98.5 m -54.86 -36.89 65.56 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.257 0.465 . . . . 64.25 112.257 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 98.3 p -69.77 -38.82 76.87 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 120.789 0.328 . . . . 74.430000000000007 110.81 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 23.1 ttt180 -61.62 -55.08 34.55 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 120.895 0.378 . . . . 73.420000000000002 111.365 175.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ALA . 20.6 mtpp -55.09 -45.18 75.41 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.001 -0.545 . . . . 61.409999999999997 110.875 -175.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.449 ' HB3' HD13 ' A' ' 12' ' ' ILE . . . -60.48 -44.59 95.76 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.312 -0.404 . . . . 74.319999999999993 111.547 176.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.563 HD22 ' HE1' ' A' ' 30' ' ' MET . 59.1 tp -62.2 -54.46 40.63 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.336 0.495 . . . . 71.420000000000002 112.336 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -69.47 -22.37 63.64 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.995 -0.441 . . . . 63.210000000000001 111.864 -177.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.54 HG23 HG21 ' A' ' 152' ' ' VAL . 61.3 m -73.5 -40.44 64.07 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 122.233 -0.292 . . . . 74.230000000000004 110.526 171.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 40' ' ' ALA . 42.3 mt -55.37 -42.34 73.79 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.058 0.392 . . . . 51.210000000000001 112.058 177.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.49 ' NH2' ' HB3' ' A' ' 19' ' ' GLU . 1.1 ptp85 -74.16 -36.05 64.06 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.007 -0.433 . . . . 74.230000000000004 111.865 176.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -63.41 -44.62 94.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.777 0.322 . . . . 73.329999999999998 111.664 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 51' ' ' VAL . 25.6 m -87.85 -33.89 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 CA-C-O 120.813 0.339 . . . . 64.450000000000003 111.699 179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.97 -29.97 72.35 Favored Glycine 0 CA--C 1.523 0.587 0 CA-C-N 116.308 -0.406 . . . . 63.109999999999999 113.265 -178.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.567 ' O ' ' HG3' ' A' ' 53' ' ' ARG . 12.3 t70 -51.19 -58.02 7.25 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.955 0.407 . . . . 74.129999999999995 110.968 176.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.02 -45.37 95.72 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 121.052 -0.594 . . . . 73.230000000000004 113.038 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 47' ' ' VAL . 95.0 t -56.8 -44.86 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 O-C-N 122.493 -0.416 . . . . 72.109999999999999 111.742 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.429 ' OE1' ' NZ ' ' A' ' 107' ' ' LYS . 48.7 mt-30 -64.73 -38.65 91.72 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 111.855 0.317 . . . . 74.519999999999996 111.855 178.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.567 ' HG3' ' O ' ' A' ' 49' ' ' ASP . 79.6 mtt-85 -61.67 -37.93 85.9 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 122.114 -0.366 . . . . 72.409999999999997 111.756 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -77.15 -46.0 24.88 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.006 0.431 . . . . 74.239999999999995 111.48 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -76.78 -21.21 55.49 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 113.033 0.753 . . . . 75.319999999999993 113.033 -175.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -50.4 -55.01 17.62 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 112.265 0.469 . . . . 74.109999999999999 112.265 -175.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -57.34 -27.69 62.46 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 120.867 0.365 . . . . 75.150000000000006 111.85 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -81.54 -47.15 13.47 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.454 -0.339 . . . . 72.25 111.724 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -60.92 -30.97 70.52 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.015 0.376 . . . . 74.219999999999999 112.015 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -52.21 -36.84 53.25 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.835 0.35 . . . . 75.109999999999999 111.195 174.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -58.68 -29.56 64.4 Favored Glycine 0 CA--C 1.527 0.809 0 CA-C-N 116.082 -0.508 . . . . 41.299999999999997 113.167 177.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.467 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 63.2 mtm -90.62 -43.88 9.89 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 122.412 -0.463 . . . . 75.549999999999997 111.658 176.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HG22 ' A' ' 105' ' ' VAL . 8.2 mp -58.87 -32.98 69.97 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.348 0.499 . . . . 75.030000000000001 112.348 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -60.96 -12.61 11.89 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.645 0.609 . . . . 74.109999999999999 112.645 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.21 5.98 9.15 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 112.522 0.564 . . . . 72.109999999999999 112.522 179.089 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 62' ' ' MET . 79.3 mt -88.73 -83.47 0.22 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 112.319 0.489 . . . . 51.450000000000003 112.319 -177.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 49.56 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.488 0.661 . . . . 63.340000000000003 112.529 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.548 HG23 ' HB2' ' A' ' 73' ' ' ASP . 2.0 mp -82.37 120.4 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-N 115.692 -0.686 . . . . 52.200000000000003 111.239 -178.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HD3' ' ND2' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -104.2 -14.39 15.86 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.234 0.457 . . . . 72.219999999999999 112.234 178.718 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.449 ' ND2' ' HD3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -164.93 178.72 6.92 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.308 0.575 . . . . 74.409999999999997 112.282 173.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -48.8 -40.48 29.29 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 113.288 0.847 . . . . 73.120000000000005 113.288 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -58.31 -35.41 71.8 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 111.769 0.285 . . . . 74.200000000000003 111.769 -175.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.548 ' HB2' HG23 ' A' ' 68' ' ' ILE . 25.3 m-20 -67.8 -41.38 83.21 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.249 0.547 . . . . 65.129999999999995 110.627 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 87.8 t -56.01 -42.95 73.68 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 115.892 -0.595 . . . . 73.219999999999999 111.019 177.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -63.04 -31.47 72.61 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.912 -0.586 . . . . 74.430000000000007 111.525 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 t -64.86 -37.49 87.8 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.13 0.49 . . . . 74.230000000000004 110.675 176.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.406 ' O ' ' HG2' ' A' ' 81' ' ' MET . 90.3 mt -59.83 -31.94 70.2 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.231 -0.441 . . . . 73.409999999999997 111.268 176.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 48.2 t -57.8 -36.77 72.67 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.109 0.48 . . . . 61.200000000000003 111.173 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -64.3 -40.98 97.04 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 116.267 -0.424 . . . . 73.129999999999995 110.656 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 99.4 t -59.01 -43.89 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 CA-C-O 120.947 0.403 . . . . 71.409999999999997 110.527 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.478 ' HB2' HG21 ' A' ' 128' ' ' VAL . 20.0 mmt -55.49 -38.67 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.201 0.524 . . . . 45.039999999999999 111.233 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 74.6 mt -61.06 -41.56 89.73 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 CA-C-N 116.024 -0.535 . . . . 74.409999999999997 111.18 175.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -66.05 -28.55 68.93 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 116.511 -0.313 . . . . 74.040000000000006 111.533 176.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 86.8 t -61.65 -35.65 68.61 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 N-CA-C 111.777 0.288 . . . . 71.219999999999999 111.777 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.579 ' CZ ' HD22 ' A' ' 98' ' ' LEU . 20.7 m-85 -91.6 28.69 1.67 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.414 0.524 . . . . 75.230000000000004 112.414 179.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.0 t -58.25 -36.77 73.72 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.572 0.582 . . . . 73.25 112.572 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -87.16 170.18 11.71 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.181 0.515 . . . . 63.450000000000003 112.115 -178.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -113.29 -1.49 24.93 Favored Glycine 0 CA--C 1.531 1.04 0 CA-C-N 116.186 -0.461 . . . . 54.020000000000003 113.638 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.503 HG23 ' HD2' ' A' ' 94' ' ' ARG . 24.9 m -60.04 138.11 21.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.75 0 CA-C-N 117.219 0.509 . . . . 74.230000000000004 111.97 178.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 51.2 p -84.94 35.62 0.58 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.596 0.591 . . . . 64.400000000000006 112.596 -172.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -84.53 108.45 17.31 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 122.119 -0.363 . . . . 71.430000000000007 111.227 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.477 ' CH2' ' HA2' ' A' ' 142' ' ' GLY . 98.7 m95 -57.35 -19.58 23.65 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 112.403 0.52 . . . . 72.200000000000003 112.403 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -55.73 -25.99 45.46 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.993 -0.622 . . . . 32.539999999999999 112.654 174.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.503 ' HD2' HG23 ' A' ' 89' ' ' VAL . 71.0 mtp180 -67.24 -40.22 86.3 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.064 0.459 . . . . 74.049999999999997 110.531 175.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.404 HG13 ' CE3' ' A' ' 92' ' ' TRP . 40.4 mm -63.7 -43.31 98.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 116.074 -0.512 . . . . 75.0 110.062 174.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 44.8 t -58.85 -42.42 85.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.894 -0.594 . . . . 70.319999999999993 110.568 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 87.2 m -58.66 -43.77 89.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-O 120.938 0.399 . . . . 75.420000000000002 111.278 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.579 HD22 ' CZ ' ' A' ' 85' ' ' PHE . 32.5 tp -61.46 -55.11 34.83 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 121.243 0.544 . . . . 63.439999999999998 111.593 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 57.0 mt -66.84 -40.68 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-N 116.13 -0.486 . . . . 55.530000000000001 111.717 -176.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 99.9 p -64.32 -44.05 92.75 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.63 -0.259 . . . . 64.310000000000002 111.172 179.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -60.8 -42.27 97.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 120.595 0.236 . . . . 74.230000000000004 110.994 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -56.89 -46.66 90.41 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 120.727 -0.749 . . . . 65.239999999999995 112.193 174.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.79 -29.53 69.5 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.105 0.478 . . . . 73.129999999999995 111.597 176.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -68.17 -47.26 68.47 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.256 -0.429 . . . . 74.340000000000003 110.647 177.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.417 HG22 HD11 ' A' ' 63' ' ' LEU . 53.8 t -64.89 -35.9 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.428 -0.351 . . . . 63.109999999999999 110.43 175.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -53.87 -43.12 69.31 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.176 -0.466 . . . . 71.010000000000005 111.453 176.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.429 ' NZ ' ' OE1' ' A' ' 52' ' ' GLN . 52.7 mttp -57.09 -45.92 82.97 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.265 0.555 . . . . 72.5 110.721 174.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.402 ' O ' HG12 ' A' ' 112' ' ' ILE . 78.4 t60 -64.04 -33.63 76.17 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.938 -0.574 . . . . 72.409999999999997 111.307 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 87.7 mt -65.34 -49.92 67.55 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.567 -0.288 . . . . 63.0 111.108 177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -58.08 -38.42 76.37 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.981 0.419 . . . . 72.329999999999998 110.796 176.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 91.2 m -57.54 -35.04 69.78 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.055 -0.52 . . . . 71.439999999999998 111.531 178.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.402 HG12 ' O ' ' A' ' 108' ' ' HIS . 31.9 pt -106.32 31.86 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-O 120.96 0.41 . . . . 71.549999999999997 111.149 176.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 10.8 p30 48.94 21.73 0.49 Allowed 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.959 1.096 . . . . 75.239999999999995 113.959 178.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -90.62 35.88 0.89 Allowed 'General case' 0 N--CA 1.473 0.722 0 O-C-N 121.998 -0.439 . . . . 63.210000000000001 111.371 175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -44.91 69.44 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 111.9 0.333 . . . . 71.25 111.9 -177.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.4 m -57.28 -27.89 62.52 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.075 0.398 . . . . 73.120000000000005 112.075 179.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 48.6 m -65.41 -25.82 67.71 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 120.882 0.373 . . . . 71.109999999999999 111.835 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -53.95 -40.76 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 112.628 0.603 . . . . 75.409999999999997 112.628 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -67.57 -52.56 26.48 Favored Pre-proline 0 CA--C 1.549 0.911 0 N-CA-C 112.379 0.511 . . . . 73.310000000000002 112.379 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -59.15 -24.97 76.27 Favored 'Trans proline' 0 C--N 1.358 1.078 0 C-N-CA 121.704 1.602 . . . . 53.520000000000003 112.308 173.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.58 -46.64 68.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.69 -0.485 . . . . 70.040000000000006 109.69 173.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.499 ' HB2' HD22 ' A' ' 17' ' ' LEU . . . -58.6 -39.21 79.75 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.291 -0.413 . . . . 72.510000000000005 111.174 174.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -57.33 -44.92 84.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.38 -0.373 . . . . 74.439999999999998 110.706 174.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 58.8 m -62.37 -45.13 94.56 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 116.373 -0.376 . . . . 73.239999999999995 111.572 179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.432 HG23 ' HG ' ' A' ' 98' ' ' LEU . 41.9 mm -54.11 -53.35 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 CA-C-O 121.44 0.638 . . . . 63.229999999999997 110.836 176.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . 0.408 HG21 ' HB2' ' A' ' 10' ' ' LEU . 41.1 m -67.4 -36.39 81.2 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.521 -0.763 . . . . 61.340000000000003 111.704 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 131' ' ' ARG . 12.7 t70 -59.93 -51.45 69.63 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.801 0.334 . . . . 43.299999999999997 110.598 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 81' ' ' MET . 57.8 t -64.95 -41.87 93.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 CA-C-O 121.049 0.452 . . . . 73.450000000000003 111.122 177.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.511 ' HG ' HD11 ' A' ' 137' ' ' LEU . 52.3 tp -54.41 -53.14 58.09 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 116.067 -0.515 . . . . 62.539999999999999 111.462 178.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.506 ' O ' ' HB2' ' A' ' 134' ' ' ARG . 94.9 t -73.52 -33.1 38.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 CA-C-N 116.187 -0.46 . . . . 74.349999999999994 111.415 179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 24.9 tpt180 -48.58 -46.71 39.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.842 0.457 . . . . 74.120000000000005 111.917 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.594 HG23 ' HD2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -114.13 -28.56 7.27 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 113.739 1.014 . . . . 64.340000000000003 113.739 -175.807 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.594 ' HD2' HG23 ' A' ' 132' ' ' THR . 3.5 mptp? -109.5 20.46 18.16 Favored 'General case' 0 N--CA 1.482 1.142 0 N-CA-C 113.409 0.892 . . . . 64.129999999999995 113.409 -177.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ARG . . . . . 0.506 ' HB2' ' O ' ' A' ' 130' ' ' VAL . 18.7 ttt180 -52.8 -53.91 41.6 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.261 0.467 . . . . 70.329999999999998 112.261 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -68.27 -40.0 82.01 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 111.866 0.321 . . . . 72.030000000000001 111.866 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -60.54 -41.39 94.4 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.631 0.253 . . . . 73.519999999999996 111.601 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 129' ' ' LEU . 40.0 mt -54.84 -55.5 29.68 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.554 -0.294 . . . . 72.099999999999994 111.756 178.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -68.85 -41.12 82.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 N-CA-C 112.218 0.451 . . . . 71.349999999999994 112.218 -178.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LYS . . . . . 0.41 ' HD3' ' HA ' ' A' ' 139' ' ' LYS . 66.5 mmtt -64.4 -39.36 93.7 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 112.52 0.563 . . . . 63.43 112.52 -179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -98.26 8.31 45.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.939 0.4 . . . . 74.519999999999996 111.411 178.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 45.0 mtt180 60.41 22.73 12.3 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.012 -0.54 . . . . 70.349999999999994 112.184 178.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . 0.477 ' HA2' ' CH2' ' A' ' 92' ' ' TRP . . . 20.82 -82.23 0.0 OUTLIER Glycine 0 C--N 1.34 0.8 0 N-CA-C 116.177 1.231 . . . . 72.200000000000003 116.177 176.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.425 ' O ' HG23 ' A' ' 147' ' ' VAL . 37.4 m95 -74.87 -41.8 59.12 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.815 0.302 . . . . 71.430000000000007 111.815 -172.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 141' ' ' ARG . 9.8 m-20 -62.66 -46.21 89.27 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.468 . . . . 73.219999999999999 110.08 174.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -66.99 -31.1 77.07 Favored Glycine 0 CA--C 1.527 0.819 0 CA-C-N 115.969 -0.559 . . . . 73.519999999999996 112.537 176.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -59.55 -51.74 68.56 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.099 0.559 . . . . 74.019999999999996 110.976 176.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 143' ' ' TRP . 59.6 t -59.65 -39.24 79.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-N 115.813 -0.631 . . . . 74.299999999999997 111.514 178.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' GLU . . . . . 0.628 ' HB3' ' HA2' ' A' ' 157' ' ' GLY . 52.6 mt-10 -73.49 -35.66 65.69 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.238 0.459 . . . . 73.120000000000005 112.238 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -62.86 -49.04 76.45 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.925 0.393 . . . . 65.450000000000003 111.473 -177.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -82.95 -16.15 48.48 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.452 -0.34 . . . . 73.010000000000005 111.237 175.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' HIS . . . . . . . . . . . . . 83.1 t60 61.33 78.76 0.27 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-O 121.493 0.664 . . . . 72.430000000000007 112.017 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.54 HG21 HG23 ' A' ' 43' ' ' THR . 69.3 t -118.45 -72.05 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-N 115.888 -0.596 . . . . 73.349999999999994 111.737 -178.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.26 26.77 9.84 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 121.392 0.615 . . . . 73.409999999999997 110.356 -176.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -88.17 166.39 14.41 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.017 -0.538 . . . . 74.120000000000005 111.86 -178.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . 0.434 HD13 ' HG2' ' A' ' 156' ' ' GLU . 0.0 OUTLIER -110.77 -10.32 14.46 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 112.066 0.395 . . . . 74.310000000000002 112.066 177.556 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . 0.434 ' HG2' HD13 ' A' ' 155' ' ' LEU . 12.0 pt-20 -134.32 -58.31 0.84 Allowed 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.375 0.509 . . . . 73.200000000000003 112.375 -177.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' GLY . . . . . 0.628 ' HA2' ' HB3' ' A' ' 148' ' ' GLU . . . 54.5 -117.93 8.67 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 121.24 -0.505 . . . . 75.409999999999997 113.717 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 97.58 164.7 31.81 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 121.438 -0.411 . . . . 51.119999999999997 113.311 179.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' HIS . . . . . . . . . . . . . 55.6 t-80 -145.08 169.11 18.77 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 122.638 -0.331 . . . . 73.409999999999997 110.565 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' HIS . . . . . . . . . . . . . 60.4 t60 70.62 21.17 5.49 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-O 121.116 0.484 . . . . 64.430000000000007 111.428 174.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -64.32 -32.51 74.14 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.296 0.57 . . . . 72.439999999999998 110.216 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' HIS . . . . . . . . . . . . . 52.5 m-70 -117.22 109.55 17.03 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.753 -0.658 . . . . 71.310000000000002 110.09 171.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -61.77 120.59 10.98 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.599 0.592 . . . . 72.329999999999998 112.599 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.844 -0.598 . . . . 73.409999999999997 110.609 172.448 . . . . . . . . 0 0 . 1 stop_ save_